[(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 3,4-diethoxybenzoate

Systemtic Name: [(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 3,4-diethoxybenzoate Openeye Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 3,4-diethoxybenzoate CAS Name: 3,4-diethoxybenzoic acid [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] 3,4-diethoxybenzoate Traditional Name: 3,4-diethoxybenzoic acid [(1R)-2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)NC3CC3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)O[C@H](C2=CC=CC=C2)C(=O)NC3CC3)OCC

InChI

InChI=1S/C22H25NO5/c1-3-26-18-13-10-16(14-19(18)27-4-2)22(25)28-20(15-8-6-5-7-9-15)21(24)23-17-11-12-17/h5-10,13-14,17,20H,3-4,11-12H2,1-2H3,(H,23,24)/t20-/m1/s1