N-[[4-[2-azanyl-2-oxidanylidene-1-(prop-2-enylamino)ethyl]-1-phenyl-cyclohexyl]methyl]-2-methoxy-benzamide

Systemtic Name: N-[[4-[2-azanyl-2-oxidanylidene-1-(prop-2-enylamino)ethyl]-1-phenyl-cyclohexyl]methyl]-2-methoxy-benzamide Openeye Name: N-[[4-[1-(allylamino)-2-amino-2-oxo-ethyl]-1-phenyl-cyclohexyl]methyl]-2-methoxy-benzamide CAS Name: N-[[4-[2-amino-2-oxo-1-(prop-2-enylamino)ethyl]-1-phenylcyclohexyl]methyl]-2-methoxybenzamide IUPAC Name: N-[[4-[2-amino-2-oxo-1-(prop-2-enylamino)ethyl]-1-phenylcyclohexyl]methyl]-2-methoxybenzamide Traditional Name: N-[[4-[1-(allylamino)-2-amino-2-keto-ethyl]-1-phenyl-cyclohexyl]methyl]-2-methoxy-benzamide Formula: C26H33N3O3 MolecularWeight: 435.55852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCC2(CCC(CC2)C(C(=O)N)NCC=C)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCC2(CCC(CC2)C(C(=O)N)NCC=C)C3=CC=CC=C3

InChI

InChI=1S/C26H33N3O3/c1-3-17-28-23(24(27)30)19-13-15-26(16-14-19,20-9-5-4-6-10-20)18-29-25(31)21-11-7-8-12-22(21)32-2/h3-12,19,23,28H,1,13-18H2,2H3,(H2,27,30)(H,29,31)