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benzoic acid, 2-methoxy-, 2-[[[4-[(1,1-dioxido-1,2-benzisothiazol-3-yl)amino]phenyl]sulfonyl](4-methylphenyl)amino]ethyl ester

View entire compound with spectra: 1 NMR

benzoic acid, 2-methoxy-, 2-[[[4-[(1,1-dioxido-1,2-benzisothiazol-3-yl)amino]phenyl]sulfonyl](4-methylphenyl)amino]ethyl ester
SpectraBase Compound ID FSiGyFdHFLH
InChI InChI=1S/C30H27N3O7S2/c1-21-11-15-23(16-12-21)33(19-20-40-30(34)25-7-3-5-9-27(25)39-2)42(37,38)24-17-13-22(14-18-24)31-29-26-8-4-6-10-28(26)41(35,36)32-29/h3-18H,19-20H2,1-2H3,(H,31,32)
InChIKey IXBHXIMYVGMFEG-UHFFFAOYSA-N
Mol Weight 605.68 g/mol
Molecular Formula C30H27N3O7S2
Exact Mass 605.129043 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 74c98xzrNBt
Name benzoic acid, 2-methoxy-, 2-[[[4-[(1,1-dioxido-1,2-benzisothiazol-3-yl)amino]phenyl]sulfonyl](4-methylphenyl)amino]ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 605.129042562 u
Formula C30H27N3O7S2
InChI InChI=1S/C30H27N3O7S2/c1-21-11-15-23(16-12-21)33(19-20-40-30(34)25-7-3-5-9-27(25)39-2)42(37,38)24-17-13-22(14-18-24)31-29-26-8-4-6-10-28(26)41(35,36)32-29/h3-18H,19-20H2,1-2H3,(H,31,32)
InChIKey IXBHXIMYVGMFEG-UHFFFAOYSA-N
Molecular Weight 605.680 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_344
Solvent DMSO-d6
Source Vendor ID: ZI/8010345; Lab Info: LP; Lab Number: LP-1900368