N-(2-azanylcyclohexyl)-N-[[2-chloranyl-5-(3,3-dimethylbutanoylamino)phenyl]methyl]-4-methoxy-benzamide

Systemtic Name: N-(2-azanylcyclohexyl)-N-[[2-chloranyl-5-(3,3-dimethylbutanoylamino)phenyl]methyl]-4-methoxy-benzamide Openeye Name: N-(2-aminocyclohexyl)-N-[[2-chloro-5-(3,3-dimethylbutanoylamino)phenyl]methyl]-4-methoxy-benzamide CAS Name: N-(2-aminocyclohexyl)-N-[[2-chloro-5-[(3,3-dimethyl-1-oxobutyl)amino]phenyl]methyl]-4-methoxybenzamide IUPAC Name: N-(2-aminocyclohexyl)-N-[[2-chloro-5-(3,3-dimethylbutanoylamino)phenyl]methyl]-4-methoxybenzamide Traditional Name: N-(2-aminocyclohexyl)-N-[2-chloro-5-(3,3-dimethylbutanoylamino)benzyl]-4-methoxy-benzamide Formula: C27H36ClN3O3 MolecularWeight: 486.04604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=CC(=C(C=C1)Cl)CN(C2CCCCC2N)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)CC(=O)NC1=CC(=C(C=C1)Cl)CN(C2CCCCC2N)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C27H36ClN3O3/c1-27(2,3)16-25(32)30-20-11-14-22(28)19(15-20)17-31(24-8-6-5-7-23(24)29)26(33)18-9-12-21(34-4)13-10-18/h9-15,23-24H,5-8,16-17,29H2,1-4H3,(H,30,32)