[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl (E)-3-(3-nitrophenyl)prop-2-enoate

Systemtic Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl (E)-3-(3-nitrophenyl)prop-2-enoate Openeye Name: [2-(p-tolyl)thiazol-4-yl]methyl (E)-3-(3-nitrophenyl)prop-2-enoate CAS Name: (E)-3-(3-nitrophenyl)-2-propenoic acid [2-(4-methylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl (E)-3-(3-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(3-nitrophenyl)acrylic acid [2-(p-tolyl)thiazol-4-yl]methyl ester Formula: C20H16N2O4S MolecularWeight: 380.41704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H16N2O4S/c1-14-5-8-16(9-6-14)20-21-17(13-27-20)12-26-19(23)10-7-15-3-2-4-18(11-15)22(24)25/h2-11,13H,12H2,1H3/b10-7+