N-[3-[[(2-azanylcyclohexyl)-(phenylcarbonyl)amino]methyl]phenyl]-3-chloranyl-benzamide

Systemtic Name: N-[3-[[(2-azanylcyclohexyl)-(phenylcarbonyl)amino]methyl]phenyl]-3-chloranyl-benzamide Openeye Name: N-[3-[[(2-aminocyclohexyl)-benzoyl-amino]methyl]phenyl]-3-chloro-benzamide CAS Name: N-[3-[[(2-aminocyclohexyl)-benzoylamino]methyl]phenyl]-3-chlorobenzamide IUPAC Name: N-[3-[[(2-aminocyclohexyl)-benzoylamino]methyl]phenyl]-3-chlorobenzamide Traditional Name: N-[3-[[(2-aminocyclohexyl)-benzoyl-amino]methyl]phenyl]-3-chloro-benzamide Formula: C27H28ClN3O2 MolecularWeight: 461.98312

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)N(CC2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)Cl)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C(C1)N)N(CC2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)Cl)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H28ClN3O2/c28-22-12-7-11-21(17-22)26(32)30-23-13-6-8-19(16-23)18-31(25-15-5-4-14-24(25)29)27(33)20-9-2-1-3-10-20/h1-3,6-13,16-17,24-25H,4-5,14-15,18,29H2,(H,30,32)