[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 3-ethoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 3-ethoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(propylamino)ethyl] 3-ethoxy-4-(2-morpholino-2-oxo-ethoxy)benzoate CAS Name: 3-ethoxy-4-[2-(4-morpholinyl)-2-oxoethoxy]benzoic acid [(2S)-1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propylamino)propan-2-yl] 3-ethoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzoate Traditional Name: 3-ethoxy-4-(2-keto-2-morpholino-ethoxy)benzoic acid [(1S)-2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C21H30N2O7 MolecularWeight: 422.4721

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=CC(=C(C=C1)OCC(=O)N2CCOCC2)OCC

Isomeric SMILES

CCCNC(=O)[C@H](C)OC(=O)C1=CC(=C(C=C1)OCC(=O)N2CCOCC2)OCC

InChI

InChI=1S/C21H30N2O7/c1-4-8-22-20(25)15(3)30-21(26)16-6-7-17(18(13-16)28-5-2)29-14-19(24)23-9-11-27-12-10-23/h6-7,13,15H,4-5,8-12,14H2,1-3H3,(H,22,25)/t15-/m0/s1