4-nitrooxybutyl 1-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]pyrrolidine-2-carboxylate

Systemtic Name: 4-nitrooxybutyl 1-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]pyrrolidine-2-carboxylate Openeye Name: 4-nitrooxybutyl 1-[2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]propanoyl]pyrrolidine-2-carboxylate CAS Name: 1-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid 4-nitrooxybutyl ester IUPAC Name: 4-nitrooxybutyl 1-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoyl]pyrrolidine-2-carboxylate Traditional Name: 1-[2-[(1-carbethoxy-3-phenyl-propyl)amino]propanoyl]pyrrolidine-2-carboxylic acid 4-nitrooxybutyl ester Formula: C24H35N3O8 MolecularWeight: 493.55

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CCCC2C(=O)OCCCCO[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CCCC2C(=O)OCCCCO[N+](=O)[O-]

InChI

InChI=1S/C24H35N3O8/c1-3-33-23(29)20(14-13-19-10-5-4-6-11-19)25-18(2)22(28)26-15-9-12-21(26)24(30)34-16-7-8-17-35-27(31)32/h4-6,10-11,18,20-21,25H,3,7-9,12-17H2,1-2H3