(E)-5-(4-dimethylaminophenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxidanylidene-pent-4-enoic acid

Systemtic Name: (E)-5-(4-dimethylaminophenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxidanylidene-pent-4-enoic acid Openeye Name: (E)-5-(4-dimethylaminophenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxo-pent-4-enoic acid CAS Name: (E)-5-(4-dimethylaminophenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxo-4-pentenoic acid IUPAC Name: (E)-5-(4-dimethylaminophenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxopent-4-enoic acid Traditional Name: (E)-5-(4-dimethylaminophenyl)-2-(1,3-dithiolan-2-ylidene)-3-keto-pent-4-enoic acid Formula: C16H17NO3S2 MolecularWeight: 335.44108

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=CC(=O)C(=C2SCCS2)C(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C/C(=O)C(=C2SCCS2)C(=O)O

InChI

InChI=1S/C16H17NO3S2/c1-17(2)12-6-3-11(4-7-12)5-8-13(18)14(15(19)20)16-21-9-10-22-16/h3-8H,9-10H2,1-2H3,(H,19,20)/b8-5+