dimethyl 5-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]oxybenzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]oxybenzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(1S)-1-methyl-2-oxo-2-(propylamino)ethoxy]benzene-1,3-dicarboxylate CAS Name: 5-[(2S)-1-oxo-1-(propylamino)propan-2-yl]oxybenzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(2S)-1-oxo-1-(propylamino)propan-2-yl]oxybenzene-1,3-dicarboxylate Traditional Name: 5-[(1S)-2-keto-1-methyl-2-(propylamino)ethoxy]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C16H21NO6 MolecularWeight: 323.34104

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC1=CC(=CC(=C1)C(=O)OC)C(=O)OC

Isomeric SMILES

CCCNC(=O)[C@H](C)OC1=CC(=CC(=C1)C(=O)OC)C(=O)OC

InChI

InChI=1S/C16H21NO6/c1-5-6-17-14(18)10(2)23-13-8-11(15(19)21-3)7-12(9-13)16(20)22-4/h7-10H,5-6H2,1-4H3,(H,17,18)/t10-/m0/s1