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

Systemtic Name: methyl 2-(1,3-benzodioxol-5-yl)-4-(4-methylphenyl)-2H-chromene-3-carboxylate Openeye Name: methyl 2-(1,3-benzodioxol-5-yl)-4-(p-tolyl)-2H-chromene-3-carboxylate CAS Name: 2-(1,3-benzodioxol-5-yl)-4-(4-methylphenyl)-2H-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(1,3-benzodioxol-5-yl)-4-(4-methylphenyl)-2H-chromene-3-carboxylate Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-(p-tolyl)-2H-chromene-3-carboxylic acid methyl ester Formula: C25H20O5 MolecularWeight: 400.4233

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(OC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(OC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)C(=O)OC

InChI

InChI=1S/C25H20O5/c1-15-7-9-16(10-8-15)22-18-5-3-4-6-19(18)30-24(23(22)25(26)27-2)17-11-12-20-21(13-17)29-14-28-20/h3-13,24H,14H2,1-2H3