N-(3-azanyl-2,2-dimethyl-propyl)-N-[[2-(2-phenoxyethanoylamino)phenyl]methyl]cyclohexanecarboxamide

Systemtic Name: N-(3-azanyl-2,2-dimethyl-propyl)-N-[[2-(2-phenoxyethanoylamino)phenyl]methyl]cyclohexanecarboxamide Openeye Name: N-(3-amino-2,2-dimethyl-propyl)-N-[[2-[(2-phenoxyacetyl)amino]phenyl]methyl]cyclohexanecarboxamide CAS Name: N-(3-amino-2,2-dimethylpropyl)-N-[[2-[(1-oxo-2-phenoxyethyl)amino]phenyl]methyl]cyclohexanecarboxamide IUPAC Name: N-(3-amino-2,2-dimethylpropyl)-N-[[2-[(2-phenoxyacetyl)amino]phenyl]methyl]cyclohexanecarboxamide Traditional Name: N-(3-amino-2,2-dimethyl-propyl)-N-[2-[(2-phenoxyacetyl)amino]benzyl]cyclohexanecarboxamide Formula: C27H37N3O3 MolecularWeight: 451.60098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN)CN(CC1=CC=CC=C1NC(=O)COC2=CC=CC=C2)C(=O)C3CCCCC3

Isomeric SMILES

CC(C)(CN)CN(CC1=CC=CC=C1NC(=O)COC2=CC=CC=C2)C(=O)C3CCCCC3

InChI

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