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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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