(2S)-3,4-dimethyl-1-(3-methylbutyl)-2-[(3-nitrophenyl)amino]-2H-pyrrol-5-one

Systemtic Name: (2S)-3,4-dimethyl-1-(3-methylbutyl)-2-[(3-nitrophenyl)amino]-2H-pyrrol-5-one Openeye Name: (2S)-1-isopentyl-3,4-dimethyl-2-(3-nitroanilino)-2H-pyrrol-5-one CAS Name: (2S)-3,4-dimethyl-1-(3-methylbutyl)-2-(3-nitroanilino)-2H-pyrrol-5-one IUPAC Name: (2S)-3,4-dimethyl-1-(3-methylbutyl)-2-(3-nitroanilino)-2H-pyrrol-5-one Traditional Name: (5S)-1-isoamyl-3,4-dimethyl-5-(3-nitroanilino)-3-pyrrolin-2-one Formula: C17H23N3O3 MolecularWeight: 317.38282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C1NC2=CC(=CC=C2)[N+](=O)[O-])CCC(C)C)C

Isomeric SMILES

CC1=C(C(=O)N([C@@H]1NC2=CC(=CC=C2)[N+](=O)[O-])CCC(C)C)C

InChI

InChI=1S/C17H23N3O3/c1-11(2)8-9-19-16(12(3)13(4)17(19)21)18-14-6-5-7-15(10-14)20(22)23/h5-7,10-11,16,18H,8-9H2,1-4H3/t16-/m0/s1