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Butyl 4-{[(4-methoxyphenyl)sulfonyl]amino}benzoate
SpectraBase Compound ID R8OUsa0b1L
InChI InChI=1S/C18H21NO5S/c1-3-4-13-24-18(20)14-5-7-15(8-6-14)19-25(21,22)17-11-9-16(23-2)10-12-17/h5-12,19H,3-4,13H2,1-2H3
InChIKey HBRBBZIMHFQLGW-UHFFFAOYSA-N
Mol Weight 363.43 g/mol
Molecular Formula C18H21NO5S
Exact Mass 363.114044 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IlX40phGRCB
Name Butyl 4-{[(4-methoxyphenyl)sulfonyl]amino}benzoate
Comments Computed using HOSE algorithm
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Exact Mass 363.114043949 u
Formula C18H21NO5S
InChI InChI=1S/C18H21NO5S/c1-3-4-13-24-18(20)14-5-7-15(8-6-14)19-25(21,22)17-11-9-16(23-2)10-12-17/h5-12,19H,3-4,13H2,1-2H3
InChIKey HBRBBZIMHFQLGW-UHFFFAOYSA-N
Molecular Weight 363.428 g/mol
SMILES N(S(C=1C=CC(OC)=CC1)(=O)=O)C1=CC=C(C(=O)OCCCC)C=C1