ethyl 2-[2-methyl-2-[3-nitro-4-(phenethylamino)phenyl]-3-oxidanylidene-3-pyrrolidin-1-yl-propoxy]ethanoate

Systemtic Name: ethyl 2-[2-methyl-2-[3-nitro-4-(phenethylamino)phenyl]-3-oxidanylidene-3-pyrrolidin-1-yl-propoxy]ethanoate Openeye Name: ethyl 2-[2-methyl-2-[3-nitro-4-(phenethylamino)phenyl]-3-oxo-3-pyrrolidin-1-yl-propoxy]acetate CAS Name: 2-[2-methyl-2-[3-nitro-4-(phenethylamino)phenyl]-3-oxo-3-(1-pyrrolidinyl)propoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-methyl-2-[3-nitro-4-(phenethylamino)phenyl]-3-oxo-3-pyrrolidin-1-ylpropoxy]acetate Traditional Name: 2-[3-keto-2-methyl-2-[3-nitro-4-(phenethylamino)phenyl]-3-pyrrolidino-propoxy]acetic acid ethyl ester Formula: C26H33N3O6 MolecularWeight: 483.55672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COCC(C)(C1=CC(=C(C=C1)NCCC2=CC=CC=C2)[N+](=O)[O-])C(=O)N3CCCC3

Isomeric SMILES

CCOC(=O)COCC(C)(C1=CC(=C(C=C1)NCCC2=CC=CC=C2)[N+](=O)[O-])C(=O)N3CCCC3

InChI

InChI=1S/C26H33N3O6/c1-3-35-24(30)18-34-19-26(2,25(31)28-15-7-8-16-28)21-11-12-22(23(17-21)29(32)33)27-14-13-20-9-5-4-6-10-20/h4-6,9-12,17,27H,3,7-8,13-16,18-19H2,1-2H3