3-(4-methoxycarbonylphenyl)-2-(4-nitrophenyl)sulfanyl-prop-2-enoic acid

Systemtic Name: 3-(4-methoxycarbonylphenyl)-2-(4-nitrophenyl)sulfanyl-prop-2-enoic acid Openeye Name: 3-(4-methoxycarbonylphenyl)-2-(4-nitrophenyl)sulfanyl-prop-2-enoic acid CAS Name: 3-(4-methoxycarbonylphenyl)-2-[(4-nitrophenyl)thio]-2-propenoic acid IUPAC Name: 3-(4-methoxycarbonylphenyl)-2-(4-nitrophenyl)sulfanylprop-2-enoic acid Traditional Name: 3-(4-carbomethoxyphenyl)-2-[(4-nitrophenyl)thio]acrylic acid Formula: C17H13NO6S MolecularWeight: 359.35322

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C(C(=O)O)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C=C(C(=O)O)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H13NO6S/c1-24-17(21)12-4-2-11(3-5-12)10-15(16(19)20)25-14-8-6-13(7-9-14)18(22)23/h2-10H,1H3,(H,19,20)