(3,4-dimethylphenyl)-(5-nitro-2-pyrrolidin-1-yl-phenyl)methanone

Systemtic Name: (3,4-dimethylphenyl)-(5-nitro-2-pyrrolidin-1-yl-phenyl)methanone Openeye Name: (3,4-dimethylphenyl)-(5-nitro-2-pyrrolidin-1-yl-phenyl)methanone CAS Name: (3,4-dimethylphenyl)-[5-nitro-2-(1-pyrrolidinyl)phenyl]methanone IUPAC Name: (3,4-dimethylphenyl)-(5-nitro-2-pyrrolidin-1-ylphenyl)methanone Traditional Name: (3,4-dimethylphenyl)-(5-nitro-2-pyrrolidino-phenyl)methanone Formula: C19H20N2O3 MolecularWeight: 324.3737

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3)C

InChI

InChI=1S/C19H20N2O3/c1-13-5-6-15(11-14(13)2)19(22)17-12-16(21(23)24)7-8-18(17)20-9-3-4-10-20/h5-8,11-12H,3-4,9-10H2,1-2H3