4-chloranyl-N-[4-(4-methylpiperidin-1-yl)-3-(phenethylcarbamoyl)phenyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[4-(4-methylpiperidin-1-yl)-3-(phenethylcarbamoyl)phenyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[4-(4-methyl-1-piperidyl)-3-(phenethylcarbamoyl)phenyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[4-(4-methyl-1-piperidinyl)-3-[oxo-(phenethylamino)methyl]phenyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[4-(4-methylpiperidin-1-yl)-3-(phenethylcarbamoyl)phenyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[4-(4-methylpiperidino)-3-(phenethylcarbamoyl)phenyl]-3-nitro-benzamide Formula: C28H29ClN4O4 MolecularWeight: 521.00726

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C28H29ClN4O4/c1-19-12-15-32(16-13-19)25-10-8-22(31-27(34)21-7-9-24(29)26(17-21)33(36)37)18-23(25)28(35)30-14-11-20-5-3-2-4-6-20/h2-10,17-19H,11-16H2,1H3,(H,30,35)(H,31,34)