N-[2-(dimethylamino)-3-phenyl-propyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[2-(dimethylamino)-3-phenyl-propyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[2-(dimethylamino)-3-phenyl-propyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[2-(dimethylamino)-3-phenylpropyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[2-(dimethylamino)-3-phenylpropyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[2-(dimethylamino)-3-phenyl-propyl]-3-nitro-4-pyrrolidino-benzamide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N4O3/c1-24(2)19(14-17-8-4-3-5-9-17)16-23-22(27)18-10-11-20(21(15-18)26(28)29)25-12-6-7-13-25/h3-5,8-11,15,19H,6-7,12-14,16H2,1-2H3,(H,23,27)