(E)-3-(4-cyanophenyl)-2-(4-nitrophenyl)sulfanyl-prop-2-enoic acid

Systemtic Name: (E)-3-(4-cyanophenyl)-2-(4-nitrophenyl)sulfanyl-prop-2-enoic acid Openeye Name: (E)-3-(4-cyanophenyl)-2-(4-nitrophenyl)sulfanyl-prop-2-enoic acid CAS Name: (E)-3-(4-cyanophenyl)-2-[(4-nitrophenyl)thio]-2-propenoic acid IUPAC Name: (E)-3-(4-cyanophenyl)-2-(4-nitrophenyl)sulfanylprop-2-enoic acid Traditional Name: (E)-3-(4-cyanophenyl)-2-[(4-nitrophenyl)thio]acrylic acid Formula: C16H10N2O4S MolecularWeight: 326.3266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C(C(=O)O)SC2=CC=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC=C1/C=C(\C(=O)O)/SC2=CC=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C16H10N2O4S/c17-10-12-3-1-11(2-4-12)9-15(16(19)20)23-14-7-5-13(6-8-14)18(21)22/h1-9H,(H,19,20)/b15-9+