(2R)-N-(4-acetamidocyclohexyl)-1-(3-nitrophenyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2R)-N-(4-acetamidocyclohexyl)-1-(3-nitrophenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: (2R)-N-(4-acetamidocyclohexyl)-1-(3-nitrobenzoyl)pyrrolidine-2-carboxamide CAS Name: (2R)-N-(4-acetamidocyclohexyl)-1-[(3-nitrophenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2R)-N-(4-acetamidocyclohexyl)-1-(3-nitrobenzoyl)pyrrolidine-2-carboxamide Traditional Name: (2R)-N-(4-acetamidocyclohexyl)-1-(3-nitrobenzoyl)pyrrolidine-2-carboxamide Formula: C20H26N4O5 MolecularWeight: 402.44424

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CCC(CC1)NC(=O)C2CCCN2C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1CCC(CC1)NC(=O)[C@H]2CCCN2C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H26N4O5/c1-13(25)21-15-7-9-16(10-8-15)22-19(26)18-6-3-11-23(18)20(27)14-4-2-5-17(12-14)24(28)29/h2,4-5,12,15-16,18H,3,6-11H2,1H3,(H,21,25)(H,22,26)/t15?,16?,18-/m1/s1