[2-(3,4-dimethoxyphenyl)-6,8-dimethyl-4-oxidanylidene-chromen-3-yl] naphthalene-2-sulfonate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-6,8-dimethyl-4-oxidanylidene-chromen-3-yl] naphthalene-2-sulfonate Openeye Name: [2-(3,4-dimethoxyphenyl)-6,8-dimethyl-4-oxo-chromen-3-yl] naphthalene-2-sulfonate CAS Name: 2-naphthalenesulfonic acid [2-(3,4-dimethoxyphenyl)-6,8-dimethyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-6,8-dimethyl-4-oxochromen-3-yl] naphthalene-2-sulfonate Traditional Name: naphthalene-2-sulfonic acid [2-(3,4-dimethoxyphenyl)-4-keto-6,8-dimethyl-chromen-3-yl] ester Formula: C29H24O7S MolecularWeight: 516.56166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)C(=C(O2)C3=CC(=C(C=C3)OC)OC)OS(=O)(=O)C4=CC5=CC=CC=C5C=C4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)C(=C(O2)C3=CC(=C(C=C3)OC)OC)OS(=O)(=O)C4=CC5=CC=CC=C5C=C4)C

InChI

InChI=1S/C29H24O7S/c1-17-13-18(2)27-23(14-17)26(30)29(28(35-27)21-10-12-24(33-3)25(16-21)34-4)36-37(31,32)22-11-9-19-7-5-6-8-20(19)15-22/h5-16H,1-4H3