[2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] 3,4-diethoxybenzoate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] 3,4-diethoxybenzoate Openeye Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 3,4-diethoxybenzoate CAS Name: 3,4-diethoxybenzoic acid [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 3,4-diethoxybenzoate Traditional Name: 3,4-diethoxybenzoic acid [2-keto-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)OCC(=O)NC[C@@H](C)C2=CC=CC=C2)OCC

InChI

InChI=1S/C22H27NO5/c1-4-26-19-12-11-18(13-20(19)27-5-2)22(25)28-15-21(24)23-14-16(3)17-9-7-6-8-10-17/h6-13,16H,4-5,14-15H2,1-3H3,(H,23,24)/t16-/m1/s1