N-(2-azanylcyclohexyl)-N-[[2-chloranyl-5-(2-phenoxyethanoylamino)phenyl]methyl]-4-methoxy-benzamide

Systemtic Name: N-(2-azanylcyclohexyl)-N-[[2-chloranyl-5-(2-phenoxyethanoylamino)phenyl]methyl]-4-methoxy-benzamide Openeye Name: N-(2-aminocyclohexyl)-N-[[2-chloro-5-[(2-phenoxyacetyl)amino]phenyl]methyl]-4-methoxy-benzamide CAS Name: N-(2-aminocyclohexyl)-N-[[2-chloro-5-[(1-oxo-2-phenoxyethyl)amino]phenyl]methyl]-4-methoxybenzamide IUPAC Name: N-(2-aminocyclohexyl)-N-[[2-chloro-5-[(2-phenoxyacetyl)amino]phenyl]methyl]-4-methoxybenzamide Traditional Name: N-(2-aminocyclohexyl)-N-[2-chloro-5-[(2-phenoxyacetyl)amino]benzyl]-4-methoxy-benzamide Formula: C29H32ClN3O4 MolecularWeight: 522.03508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N(CC2=C(C=CC(=C2)NC(=O)COC3=CC=CC=C3)Cl)C4CCCCC4N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N(CC2=C(C=CC(=C2)NC(=O)COC3=CC=CC=C3)Cl)C4CCCCC4N

InChI

InChI=1S/C29H32ClN3O4/c1-36-23-14-11-20(12-15-23)29(35)33(27-10-6-5-9-26(27)31)18-21-17-22(13-16-25(21)30)32-28(34)19-37-24-7-3-2-4-8-24/h2-4,7-8,11-17,26-27H,5-6,9-10,18-19,31H2,1H3,(H,32,34)