[2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 2-(phenylmethyl)benzoate

Systemtic Name: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 2-(phenylmethyl)benzoate Openeye Name: [2-(isopentylamino)-2-oxo-ethyl] 2-benzylbenzoate CAS Name: 2-(phenylmethyl)benzoic acid [2-(3-methylbutylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylamino)-2-oxoethyl] 2-benzylbenzoate Traditional Name: 2-benzylbenzoic acid [2-(isoamylamino)-2-keto-ethyl] ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)COC(=O)C1=CC=CC=C1CC2=CC=CC=C2

Isomeric SMILES

CC(C)CCNC(=O)COC(=O)C1=CC=CC=C1CC2=CC=CC=C2

InChI

InChI=1S/C21H25NO3/c1-16(2)12-13-22-20(23)15-25-21(24)19-11-7-6-10-18(19)14-17-8-4-3-5-9-17/h3-11,16H,12-15H2,1-2H3,(H,22,23)