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

Systemtic Name: N-(2-azanylcyclohexyl)-3,3-dimethyl-N-[[2-(2-phenoxyethanoylamino)phenyl]methyl]butanamide Openeye Name: N-(2-aminocyclohexyl)-3,3-dimethyl-N-[[2-[(2-phenoxyacetyl)amino]phenyl]methyl]butanamide CAS Name: N-(2-aminocyclohexyl)-3,3-dimethyl-N-[[2-[(1-oxo-2-phenoxyethyl)amino]phenyl]methyl]butanamide IUPAC Name: N-(2-aminocyclohexyl)-3,3-dimethyl-N-[[2-[(2-phenoxyacetyl)amino]phenyl]methyl]butanamide Traditional Name: N-(2-aminocyclohexyl)-3,3-dimethyl-N-[2-[(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=CC=C1NC(=O)COC2=CC=CC=C2)C3CCCCC3N

Isomeric SMILES

CC(C)(C)CC(=O)N(CC1=CC=CC=C1NC(=O)COC2=CC=CC=C2)C3CCCCC3N

InChI

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