N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-3-nitro-4-pyrrolidino-benzamide Formula: C21H25ClN4O3 MolecularWeight: 416.9012

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=CC(=C(C=C1)N2CCCC2)[N+](=O)[O-])C3=CC=CC=C3Cl

Isomeric SMILES

CN(C)C(CNC(=O)C1=CC(=C(C=C1)N2CCCC2)[N+](=O)[O-])C3=CC=CC=C3Cl

InChI

InChI=1S/C21H25ClN4O3/c1-24(2)20(16-7-3-4-8-17(16)22)14-23-21(27)15-9-10-18(19(13-15)26(28)29)25-11-5-6-12-25/h3-4,7-10,13,20H,5-6,11-12,14H2,1-2H3,(H,23,27)