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

Systemtic Name: 4-chloranyl-3-nitro-N-[3-(1-phenylethylcarbamoyl)-4-piperidin-1-yl-phenyl]benzamide Openeye Name: 4-chloro-3-nitro-N-[3-(1-phenylethylcarbamoyl)-4-(1-piperidyl)phenyl]benzamide CAS Name: 4-chloro-3-nitro-N-[3-[oxo-(1-phenylethylamino)methyl]-4-(1-piperidinyl)phenyl]benzamide IUPAC Name: 4-chloro-3-nitro-N-[3-(1-phenylethylcarbamoyl)-4-piperidin-1-ylphenyl]benzamide Traditional Name: 4-chloro-3-nitro-N-[3-(1-phenylethylcarbamoyl)-4-piperidino-phenyl]benzamide Formula: C27H27ClN4O4 MolecularWeight: 506.98068

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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-])N4CCCCC4

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-])N4CCCCC4

InChI

InChI=1S/C27H27ClN4O4/c1-18(19-8-4-2-5-9-19)29-27(34)22-17-21(11-13-24(22)31-14-6-3-7-15-31)30-26(33)20-10-12-23(28)25(16-20)32(35)36/h2,4-5,8-13,16-18H,3,6-7,14-15H2,1H3,(H,29,34)(H,30,33)