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

Systemtic Name: methyl 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(2-methoxyphenyl)-2H-chromene-3-carboxylate Openeye Name: methyl 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(2-methoxyphenyl)-2H-chromene-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(2-methoxyphenyl)-2H-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(2-methoxyphenyl)-2H-chromene-3-carboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(2-methoxyphenyl)-2H-chromene-3-carboxylic acid methyl ester Formula: C29H28O7 MolecularWeight: 488.52842

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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=CC=CC=C5OC

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)OC(C(=C2C3=CC4=C(C=C3)OCO4)C(=O)OC)C5=CC=CC=C5OC

InChI

InChI=1S/C29H28O7/c1-4-5-14-33-19-11-13-23-21(16-19)26(18-10-12-24-25(15-18)35-17-34-24)27(29(30)32-3)28(36-23)20-8-6-7-9-22(20)31-2/h6-13,15-16,28H,4-5,14,17H2,1-3H3