methyl 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(2,5-dimethoxyphenyl)-2H-chromene-3-carboxylate

Systemtic Name: methyl 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(2,5-dimethoxyphenyl)-2H-chromene-3-carboxylate Openeye Name: methyl 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(2,5-dimethoxyphenyl)-2H-chromene-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(2,5-dimethoxyphenyl)-2H-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(2,5-dimethoxyphenyl)-2H-chromene-3-carboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(2,5-dimethoxyphenyl)-2H-chromene-3-carboxylic acid methyl ester Formula: C30H30O8 MolecularWeight: 518.5544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)OC(C(=C2C3=CC4=C(C=C3)OCO4)C(=O)OC)C5=C(C=CC(=C5)OC)OC

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)OC(C(=C2C3=CC4=C(C=C3)OCO4)C(=O)OC)C5=C(C=CC(=C5)OC)OC

InChI

InChI=1S/C30H30O8/c1-5-6-13-35-20-9-12-24-21(16-20)27(18-7-10-25-26(14-18)37-17-36-25)28(30(31)34-4)29(38-24)22-15-19(32-2)8-11-23(22)33-3/h7-12,14-16,29H,5-6,13,17H2,1-4H3