[1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl] 3-methoxy-4-(2-methylpropoxy)benzoate

Systemtic Name: [1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl] 3-methoxy-4-(2-methylpropoxy)benzoate Openeye Name: [2-(benzylamino)-1-methyl-2-oxo-ethyl] 4-isobutoxy-3-methoxy-benzoate CAS Name: 3-methoxy-4-(2-methylpropoxy)benzoic acid [1-oxo-1-[(phenylmethyl)amino]propan-2-yl] ester IUPAC Name: [1-(benzylamino)-1-oxopropan-2-yl] 3-methoxy-4-(2-methylpropoxy)benzoate Traditional Name: 4-isobutoxy-3-methoxy-benzoic acid [2-(benzylamino)-2-keto-1-methyl-ethyl] ester Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)OC(C)C(=O)NCC2=CC=CC=C2)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)OC(C)C(=O)NCC2=CC=CC=C2)OC

InChI

InChI=1S/C22H27NO5/c1-15(2)14-27-19-11-10-18(12-20(19)26-4)22(25)28-16(3)21(24)23-13-17-8-6-5-7-9-17/h5-12,15-16H,13-14H2,1-4H3,(H,23,24)