(3-nitrophenyl) (E)-3-(4-methylsulfanylphenyl)prop-2-enoate

Systemtic Name: (3-nitrophenyl) (E)-3-(4-methylsulfanylphenyl)prop-2-enoate Openeye Name: (3-nitrophenyl) (E)-3-(4-methylsulfanylphenyl)prop-2-enoate CAS Name: (E)-3-[4-(methylthio)phenyl]-2-propenoic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) (E)-3-(4-methylsulfanylphenyl)prop-2-enoate Traditional Name: (E)-3-[4-(methylthio)phenyl]acrylic acid (3-nitrophenyl) ester Formula: C16H13NO4S MolecularWeight: 315.34372

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=CC(=O)OC2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C/C(=O)OC2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H13NO4S/c1-22-15-8-5-12(6-9-15)7-10-16(18)21-14-4-2-3-13(11-14)17(19)20/h2-11H,1H3/b10-7+