(phenylmethyl) N-[1-[(2-azanylcyclohexyl)amino]-3-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[(2-azanylcyclohexyl)amino]-3-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: benzyl N-[2-[(2-aminocyclohexyl)amino]-1-[(4-methoxyphenyl)methyl]-2-oxo-ethyl]carbamate CAS Name: N-[1-[(2-aminocyclohexyl)amino]-3-(4-methoxyphenyl)-1-oxopropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[(2-aminocyclohexyl)amino]-3-(4-methoxyphenyl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-[(2-aminocyclohexyl)amino]-2-keto-1-p-anisyl-ethyl]carbamic acid benzyl ester Formula: C24H31N3O4 MolecularWeight: 425.52064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(C(=O)NC2CCCCC2N)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)CC(C(=O)NC2CCCCC2N)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O4/c1-30-19-13-11-17(12-14-19)15-22(23(28)26-21-10-6-5-9-20(21)25)27-24(29)31-16-18-7-3-2-4-8-18/h2-4,7-8,11-14,20-22H,5-6,9-10,15-16,25H2,1H3,(H,26,28)(H,27,29)