N-(2-azanylcyclohexyl)-3,3-dimethyl-N-[[4-(2-phenoxyethanoylamino)phenyl]methyl]butanamide

Systemtic Name: N-(2-azanylcyclohexyl)-3,3-dimethyl-N-[[4-(2-phenoxyethanoylamino)phenyl]methyl]butanamide Openeye Name: N-(2-aminocyclohexyl)-3,3-dimethyl-N-[[4-[(2-phenoxyacetyl)amino]phenyl]methyl]butanamide CAS Name: N-(2-aminocyclohexyl)-3,3-dimethyl-N-[[4-[(1-oxo-2-phenoxyethyl)amino]phenyl]methyl]butanamide IUPAC Name: N-(2-aminocyclohexyl)-3,3-dimethyl-N-[[4-[(2-phenoxyacetyl)amino]phenyl]methyl]butanamide Traditional Name: N-(2-aminocyclohexyl)-3,3-dimethyl-N-[4-[(2-phenoxyacetyl)amino]benzyl]butyramide 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)COC2=CC=CC=C2)C3CCCCC3N

Isomeric SMILES

CC(C)(C)CC(=O)N(CC1=CC=C(C=C1)NC(=O)COC2=CC=CC=C2)C3CCCCC3N

InChI

InChI=1S/C27H37N3O3/c1-27(2,3)17-26(32)30(24-12-8-7-11-23(24)28)18-20-13-15-21(16-14-20)29-25(31)19-33-22-9-5-4-6-10-22/h4-6,9-10,13-16,23-24H,7-8,11-12,17-19,28H2,1-3H3,(H,29,31)