(2S)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)C2CCCN2C(=O)C3=CC=CS3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)[C@@H]2CCCN2C(=O)C3=CC=CS3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H23N3O6S/c1-28-16-11-13(15(23(26)27)12-17(16)29-2)7-8-21-19(24)14-5-3-9-22(14)20(25)18-6-4-10-30-18/h4,6,10-12,14H,3,5,7-9H2,1-2H3,(H,21,24)/t14-/m0/s1