[6-chloranyl-2-(3,4-dimethoxyphenyl)-7-methyl-4-oxidanylidene-chromen-3-yl] cyclohexanecarboxylate

Systemtic Name: [6-chloranyl-2-(3,4-dimethoxyphenyl)-7-methyl-4-oxidanylidene-chromen-3-yl] cyclohexanecarboxylate Openeye Name: [6-chloro-2-(3,4-dimethoxyphenyl)-7-methyl-4-oxo-chromen-3-yl] cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [6-chloro-2-(3,4-dimethoxyphenyl)-7-methyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [6-chloro-2-(3,4-dimethoxyphenyl)-7-methyl-4-oxochromen-3-yl] cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [6-chloro-2-(3,4-dimethoxyphenyl)-4-keto-7-methyl-chromen-3-yl] ester Formula: C25H25ClO6 MolecularWeight: 456.9154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=C(C2=O)OC(=O)C3CCCCC3)C4=CC(=C(C=C4)OC)OC)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=C(C2=O)OC(=O)C3CCCCC3)C4=CC(=C(C=C4)OC)OC)Cl

InChI

InChI=1S/C25H25ClO6/c1-14-11-20-17(13-18(14)26)22(27)24(32-25(28)15-7-5-4-6-8-15)23(31-20)16-9-10-19(29-2)21(12-16)30-3/h9-13,15H,4-8H2,1-3H3