[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl] 4-(1,3-dithian-2-yl)benzoate

Systemtic Name: [2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl] 4-(1,3-dithian-2-yl)benzoate Openeye Name: [2-(3,4-diethoxyanilino)-2-oxo-ethyl] 4-(1,3-dithian-2-yl)benzoate CAS Name: 4-(1,3-dithian-2-yl)benzoic acid [2-(3,4-diethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-diethoxyanilino)-2-oxoethyl] 4-(1,3-dithian-2-yl)benzoate Traditional Name: 4-(1,3-dithian-2-yl)benzoic acid [2-(3,4-diethoxyanilino)-2-keto-ethyl] ester Formula: C23H27NO5S2 MolecularWeight: 461.59418

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)COC(=O)C2=CC=C(C=C2)C3SCCCS3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)COC(=O)C2=CC=C(C=C2)C3SCCCS3)OCC

InChI

InChI=1S/C23H27NO5S2/c1-3-27-19-11-10-18(14-20(19)28-4-2)24-21(25)15-29-22(26)16-6-8-17(9-7-16)23-30-12-5-13-31-23/h6-11,14,23H,3-5,12-13,15H2,1-2H3,(H,24,25)