[2-oxidanylidene-2-[[(1R)-1-phenylethyl]amino]ethyl] 3-methoxy-4-(2-methylpropoxy)benzoate

Systemtic Name: [2-oxidanylidene-2-[[(1R)-1-phenylethyl]amino]ethyl] 3-methoxy-4-(2-methylpropoxy)benzoate Openeye Name: [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 4-isobutoxy-3-methoxy-benzoate CAS Name: 3-methoxy-4-(2-methylpropoxy)benzoic acid [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 3-methoxy-4-(2-methylpropoxy)benzoate Traditional Name: 4-isobutoxy-3-methoxy-benzoic acid [2-keto-2-[[(1R)-1-phenylethyl]amino]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)OCC(=O)NC(C)C2=CC=CC=C2)OC

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)COC(=O)C2=CC(=C(C=C2)OCC(C)C)OC

InChI

InChI=1S/C22H27NO5/c1-15(2)13-27-19-11-10-18(12-20(19)26-4)22(25)28-14-21(24)23-16(3)17-8-6-5-7-9-17/h5-12,15-16H,13-14H2,1-4H3,(H,23,24)/t16-/m1/s1