N-[4-[[(4-azanylcyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]-3-methoxy-benzamide

Systemtic Name: N-[4-[[(4-azanylcyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]-3-methoxy-benzamide Openeye Name: N-[4-[[(4-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]-3-methoxy-benzamide CAS Name: N-[4-[[(4-aminocyclohexyl)-(3,3-dimethyl-1-oxobutyl)amino]methyl]phenyl]-3-methoxybenzamide IUPAC Name: N-[4-[[(4-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]-3-methoxybenzamide Traditional Name: N-[4-[[(4-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]-3-methoxy-benzamide Formula: C27H37N3O3 MolecularWeight: 451.60098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N(CC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)OC)C3CCC(CC3)N

Isomeric SMILES

CC(C)(C)CC(=O)N(CC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)OC)C3CCC(CC3)N

InChI

InChI=1S/C27H37N3O3/c1-27(2,3)17-25(31)30(23-14-10-21(28)11-15-23)18-19-8-12-22(13-9-19)29-26(32)20-6-5-7-24(16-20)33-4/h5-9,12-13,16,21,23H,10-11,14-15,17-18,28H2,1-4H3,(H,29,32)