N-cyclopropyl-N-[(4-methylphenyl)methyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-cyclopropyl-N-[(4-methylphenyl)methyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-cyclopropyl-3-nitro-N-(p-tolylmethyl)-4-pyrrolidin-1-yl-benzamide CAS Name: N-cyclopropyl-N-[(4-methylphenyl)methyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-cyclopropyl-N-[(4-methylphenyl)methyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-cyclopropyl-N-(4-methylbenzyl)-3-nitro-4-pyrrolidino-benzamide Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2CC2)C(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2CC2)C(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H25N3O3/c1-16-4-6-17(7-5-16)15-24(19-9-10-19)22(26)18-8-11-20(21(14-18)25(27)28)23-12-2-3-13-23/h4-8,11,14,19H,2-3,9-10,12-13,15H2,1H3