[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 3-ethoxy-4-(2-methylpropoxy)benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)OCC(=O)NCC2=CC=CC=C2)OCC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)OCC(=O)NCC2=CC=CC=C2)OCC(C)C

InChI

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