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

Systemtic Name: [2-(4-ethoxy-3-methoxy-phenyl)-1,3-thiazol-4-yl]methyl (E)-3-(3-nitrophenyl)prop-2-enoate Openeye Name: [2-(4-ethoxy-3-methoxy-phenyl)thiazol-4-yl]methyl (E)-3-(3-nitrophenyl)prop-2-enoate CAS Name: (E)-3-(3-nitrophenyl)-2-propenoic acid [2-(4-ethoxy-3-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazol-4-yl]methyl (E)-3-(3-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(3-nitrophenyl)acrylic acid [2-(4-ethoxy-3-methoxy-phenyl)thiazol-4-yl]methyl ester Formula: C22H20N2O6S MolecularWeight: 440.469

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=CS2)COC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=CS2)COC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H20N2O6S/c1-3-29-19-9-8-16(12-20(19)28-2)22-23-17(14-31-22)13-30-21(25)10-7-15-5-4-6-18(11-15)24(26)27/h4-12,14H,3,13H2,1-2H3/b10-7+