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4-(4-Chloro-anilino)carbonyl-3-methoxycarbonyl-1-methoxycarbonylamino-2,5-dimethyl-pyrrole
SpectraBase Compound ID EeBor6mN3Sw
InChI InChI=1S/C17H18ClN3O5/c1-9-13(15(22)19-12-7-5-11(18)6-8-12)14(16(23)25-3)10(2)21(9)20-17(24)26-4/h5-8H,1-4H3,(H,19,22)(H,20,24)
InChIKey HUHNBUOHNMQPIV-UHFFFAOYSA-N
Mol Weight 379.8 g/mol
Molecular Formula C17H18ClN3O5
Exact Mass 379.093498 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ddy0XkQuOTR
Name 4-(4-Chloro-anilino)carbonyl-3-methoxycarbonyl-1-methoxycarbonylamino-2,5-dimethyl-pyrrole
CAS Registry Number 95239-07-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H18ClN3O5
InChI InChI=1S/C17H18ClN3O5/c1-9-13(15(22)19-12-7-5-11(18)6-8-12)14(16(23)25-3)10(2)21(9)20-17(24)26-4/h5-8H,1-4H3,(H,19,22)(H,20,24)
InChIKey HUHNBUOHNMQPIV-UHFFFAOYSA-N
Instrument Name Bruker CXP-300
Literature Reference O.A. Attanasi, M. Grossi, F.R. Perrulli, Magn. Res. Chem. 26, 714 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3