tetramethyl 6'-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-5',5',9'-trimethyl-spiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate

Systemtic Name: tetramethyl 6'-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-5',5',9'-trimethyl-spiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate Openeye Name: tetramethyl 6'-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-5',5',9'-trimethyl-spiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate CAS Name: 6'-[(E)-3-(3,4-dimethoxyphenyl)-1-oxoprop-2-enyl]-5',5',9'-trimethylspiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylic acid tetramethyl ester IUPAC Name: tetramethyl 6'-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-5',5',9'-trimethylspiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate Traditional Name: 6'-[(E)-3-(3,4-dimethoxyphenyl)acryloyl]-5',5',9'-trimethyl-spiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylic acid tetramethyl ester Formula: C36H35NO11S3 MolecularWeight: 753.8582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(C3=C2C4(C(=C(S3)C(=O)OC)C(=O)OC)SC(=C(S4)C(=O)OC)C(=O)OC)(C)C)C(=O)C=CC5=CC(=C(C=C5)OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(C3=C2C4(C(=C(S3)C(=O)OC)C(=O)OC)SC(=C(S4)C(=O)OC)C(=O)OC)(C)C)C(=O)/C=C/C5=CC(=C(C=C5)OC)OC

InChI

InChI=1S/C36H35NO11S3/c1-18-10-13-21-20(16-18)25-30(35(2,3)37(21)24(38)15-12-19-11-14-22(43-4)23(17-19)44-5)49-27(32(40)46-7)26(31(39)45-6)36(25)50-28(33(41)47-8)29(51-36)34(42)48-9/h10-17H,1-9H3/b15-12+