1-[2-(4-methylphenyl)pyrrolidin-1-yl]-3-(4-nitroimidazol-1-yl)propan-1-one

Systemtic Name: 1-[2-(4-methylphenyl)pyrrolidin-1-yl]-3-(4-nitroimidazol-1-yl)propan-1-one Openeye Name: 3-(4-nitroimidazol-1-yl)-1-[2-(p-tolyl)pyrrolidin-1-yl]propan-1-one CAS Name: 1-[2-(4-methylphenyl)-1-pyrrolidinyl]-3-(4-nitro-1-imidazolyl)-1-propanone IUPAC Name: 1-[2-(4-methylphenyl)pyrrolidin-1-yl]-3-(4-nitroimidazol-1-yl)propan-1-one Traditional Name: 3-(4-nitroimidazol-1-yl)-1-[2-(p-tolyl)pyrrolidino]propan-1-one Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CCCN2C(=O)CCN3C=C(N=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2CCCN2C(=O)CCN3C=C(N=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O3/c1-13-4-6-14(7-5-13)15-3-2-9-20(15)17(22)8-10-19-11-16(18-12-19)21(23)24/h4-7,11-12,15H,2-3,8-10H2,1H3