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

Systemtic Name: methyl 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(3-methoxyphenyl)-2H-chromene-3-carboxylate Openeye Name: methyl 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(3-methoxyphenyl)-2H-chromene-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(3-methoxyphenyl)-2H-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(3-methoxyphenyl)-2H-chromene-3-carboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(3-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=C5)OC

Isomeric SMILES

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

InChI

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