(E)-2-(2-methylphenyl)-3-(4-nitrophenyl)prop-2-enoic acid

Systemtic Name: (E)-2-(2-methylphenyl)-3-(4-nitrophenyl)prop-2-enoic acid Openeye Name: (E)-3-(4-nitrophenyl)-2-(o-tolyl)prop-2-enoic acid CAS Name: (E)-2-(2-methylphenyl)-3-(4-nitrophenyl)-2-propenoic acid IUPAC Name: (E)-2-(2-methylphenyl)-3-(4-nitrophenyl)prop-2-enoic acid Traditional Name: (E)-3-(4-nitrophenyl)-2-(o-tolyl)acrylic acid Formula: C16H13NO4 MolecularWeight: 283.27872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=CC=CC=C1/C(=C\C2=CC=C(C=C2)[N+](=O)[O-])/C(=O)O

InChI

InChI=1S/C16H13NO4/c1-11-4-2-3-5-14(11)15(16(18)19)10-12-6-8-13(9-7-12)17(20)21/h2-10H,1H3,(H,18,19)/b15-10+