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

Systemtic Name: 4-chloranyl-N-[4-(4-methylpiperidin-1-yl)-3-(pyridin-3-ylmethylcarbamoyl)phenyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[4-(4-methyl-1-piperidyl)-3-(3-pyridylmethylcarbamoyl)phenyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[4-(4-methyl-1-piperidinyl)-3-[oxo-(3-pyridinylmethylamino)methyl]phenyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[4-(4-methylpiperidin-1-yl)-3-(pyridin-3-ylmethylcarbamoyl)phenyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[4-(4-methylpiperidino)-3-(3-pyridylmethylcarbamoyl)phenyl]-3-nitro-benzamide Formula: C26H26ClN5O4 MolecularWeight: 507.96874

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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)NCC4=CN=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)NCC4=CN=CC=C4

InChI

InChI=1S/C26H26ClN5O4/c1-17-8-11-31(12-9-17)23-7-5-20(14-21(23)26(34)29-16-18-3-2-10-28-15-18)30-25(33)19-4-6-22(27)24(13-19)32(35)36/h2-7,10,13-15,17H,8-9,11-12,16H2,1H3,(H,29,34)(H,30,33)