ethyl 3-(1,3-benzothiazol-2-yl)-4-oxidanylidene-7-[(E)-3-phenylprop-2-enoyl]oxy-chromene-2-carboxylate

Systemtic Name: ethyl 3-(1,3-benzothiazol-2-yl)-4-oxidanylidene-7-[(E)-3-phenylprop-2-enoyl]oxy-chromene-2-carboxylate Openeye Name: ethyl 3-(1,3-benzothiazol-2-yl)-4-oxo-7-[(E)-3-phenylprop-2-enoyl]oxy-chromene-2-carboxylate CAS Name: 3-(1,3-benzothiazol-2-yl)-4-oxo-7-[(E)-1-oxo-3-phenylprop-2-enoxy]-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzothiazol-2-yl)-4-oxo-7-[(E)-3-phenylprop-2-enoyl]oxychromene-2-carboxylate Traditional Name: 3-(1,3-benzothiazol-2-yl)-4-keto-7-[(E)-3-phenylacryloyl]oxy-chromene-2-carboxylic acid ethyl ester Formula: C28H19NO6S MolecularWeight: 497.51856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C=CC3=CC=CC=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)/C=C/C3=CC=CC=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C28H19NO6S/c1-2-33-28(32)26-24(27-29-20-10-6-7-11-22(20)36-27)25(31)19-14-13-18(16-21(19)35-26)34-23(30)15-12-17-8-4-3-5-9-17/h3-16H,2H2,1H3/b15-12+