4-chloranyl-3-nitro-N-[3-(1-phenylethylcarbamoyl)-4-pyrrolidin-1-yl-phenyl]benzamide

Systemtic Name: 4-chloranyl-3-nitro-N-[3-(1-phenylethylcarbamoyl)-4-pyrrolidin-1-yl-phenyl]benzamide Openeye Name: 4-chloro-3-nitro-N-[3-(1-phenylethylcarbamoyl)-4-pyrrolidin-1-yl-phenyl]benzamide CAS Name: 4-chloro-3-nitro-N-[3-[oxo-(1-phenylethylamino)methyl]-4-(1-pyrrolidinyl)phenyl]benzamide IUPAC Name: 4-chloro-3-nitro-N-[3-(1-phenylethylcarbamoyl)-4-pyrrolidin-1-ylphenyl]benzamide Traditional Name: 4-chloro-3-nitro-N-[3-(1-phenylethylcarbamoyl)-4-pyrrolidino-phenyl]benzamide Formula: C26H25ClN4O4 MolecularWeight: 492.9541

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])N4CCCC4

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])N4CCCC4

InChI

InChI=1S/C26H25ClN4O4/c1-17(18-7-3-2-4-8-18)28-26(33)21-16-20(10-12-23(21)30-13-5-6-14-30)29-25(32)19-9-11-22(27)24(15-19)31(34)35/h2-4,7-12,15-17H,5-6,13-14H2,1H3,(H,28,33)(H,29,32)