(phenylmethyl) 3-[2-(4-aminophenyl)ethyl]-4-methyl-3-oxidanyl-pentanoate

Systemtic Name: (phenylmethyl) 3-[2-(4-aminophenyl)ethyl]-4-methyl-3-oxidanyl-pentanoate Openeye Name: benzyl 3-[2-(4-aminophenyl)ethyl]-3-hydroxy-4-methyl-pentanoate CAS Name: 3-[2-(4-aminophenyl)ethyl]-3-hydroxy-4-methylpentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[2-(4-aminophenyl)ethyl]-3-hydroxy-4-methylpentanoate Traditional Name: 3-[2-(4-aminophenyl)ethyl]-3-hydroxy-4-methyl-valeric acid benzyl ester Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCC1=CC=C(C=C1)N)(CC(=O)OCC2=CC=CC=C2)O

Isomeric SMILES

CC(C)C(CCC1=CC=C(C=C1)N)(CC(=O)OCC2=CC=CC=C2)O

InChI

InChI=1S/C21H27NO3/c1-16(2)21(24,13-12-17-8-10-19(22)11-9-17)14-20(23)25-15-18-6-4-3-5-7-18/h3-11,16,24H,12-15,22H2,1-2H3