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

Systemtic Name: 4-azanyl-N-[2-(2-chlorophenyl)-2-pyrrolidin-1-yl-ethyl]-3-nitro-benzamide Openeye Name: 4-amino-N-[2-(2-chlorophenyl)-2-pyrrolidin-1-yl-ethyl]-3-nitro-benzamide CAS Name: 4-amino-N-[2-(2-chlorophenyl)-2-(1-pyrrolidinyl)ethyl]-3-nitrobenzamide IUPAC Name: 4-amino-N-[2-(2-chlorophenyl)-2-pyrrolidin-1-ylethyl]-3-nitrobenzamide Traditional Name: 4-amino-N-[2-(2-chlorophenyl)-2-pyrrolidino-ethyl]-3-nitro-benzamide Formula: C19H21ClN4O3 MolecularWeight: 388.84804

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-])C3=CC=CC=C3Cl

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-])C3=CC=CC=C3Cl

InChI

InChI=1S/C19H21ClN4O3/c20-15-6-2-1-5-14(15)18(23-9-3-4-10-23)12-22-19(25)13-7-8-16(21)17(11-13)24(26)27/h1-2,5-8,11,18H,3-4,9-10,12,21H2,(H,22,25)