(phenylmethyl) 2-[[3-(4-aminophenyl)-1-methoxy-1-oxidanylidene-propan-2-yl]amino]-4-methyl-pentanoate

Systemtic Name: (phenylmethyl) 2-[[3-(4-aminophenyl)-1-methoxy-1-oxidanylidene-propan-2-yl]amino]-4-methyl-pentanoate Openeye Name: benzyl 2-[[1-[(4-aminophenyl)methyl]-2-methoxy-2-oxo-ethyl]amino]-4-methyl-pentanoate CAS Name: 2-[[3-(4-aminophenyl)-1-methoxy-1-oxopropan-2-yl]amino]-4-methylpentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[3-(4-aminophenyl)-1-methoxy-1-oxopropan-2-yl]amino]-4-methylpentanoate Traditional Name: 2-[[1-(4-aminobenzyl)-2-keto-2-methoxy-ethyl]amino]-4-methyl-valeric acid benzyl ester Formula: C23H30N2O4 MolecularWeight: 398.4953

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC1=CC=CC=C1)NC(CC2=CC=C(C=C2)N)C(=O)OC

Isomeric SMILES

CC(C)CC(C(=O)OCC1=CC=CC=C1)NC(CC2=CC=C(C=C2)N)C(=O)OC

InChI

InChI=1S/C23H30N2O4/c1-16(2)13-20(23(27)29-15-18-7-5-4-6-8-18)25-21(22(26)28-3)14-17-9-11-19(24)12-10-17/h4-12,16,20-21,25H,13-15,24H2,1-3H3