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

Systemtic Name: methyl 2-(1,3-benzodioxol-5-yl)-4-(3-methoxyphenyl)-2H-chromene-3-carboxylate Openeye Name: methyl 2-(1,3-benzodioxol-5-yl)-4-(3-methoxyphenyl)-2H-chromene-3-carboxylate CAS Name: 2-(1,3-benzodioxol-5-yl)-4-(3-methoxyphenyl)-2H-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(1,3-benzodioxol-5-yl)-4-(3-methoxyphenyl)-2H-chromene-3-carboxylate Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-(3-methoxyphenyl)-2H-chromene-3-carboxylic acid methyl ester Formula: C25H20O6 MolecularWeight: 416.4227

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C(C(OC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)C(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1)C2=C(C(OC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)C(=O)OC

InChI

InChI=1S/C25H20O6/c1-27-17-7-5-6-15(12-17)22-18-8-3-4-9-19(18)31-24(23(22)25(26)28-2)16-10-11-20-21(13-16)30-14-29-20/h3-13,24H,14H2,1-2H3