[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methyl (E)-3-(3-nitrophenyl)prop-2-enoate

Systemtic Name: [2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methyl (E)-3-(3-nitrophenyl)prop-2-enoate Openeye Name: [2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methyl (E)-3-(3-nitrophenyl)prop-2-enoate CAS Name: (E)-3-(3-nitrophenyl)-2-propenoic acid [2-(5-bromo-2-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]methyl (E)-3-(3-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(3-nitrophenyl)acrylic acid [2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methyl ester Formula: C20H15BrN2O5S MolecularWeight: 475.3125

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C2=NC(=CS2)COC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C2=NC(=CS2)COC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H15BrN2O5S/c1-27-18-7-6-14(21)10-17(18)20-22-15(12-29-20)11-28-19(24)8-5-13-3-2-4-16(9-13)23(25)26/h2-10,12H,11H2,1H3/b8-5+