methyl 2-(1,3-benzodioxol-5-yl)-4-decoxy-6-propan-2-yloxy-2H-chromene-3-carboxylate

Systemtic Name: methyl 2-(1,3-benzodioxol-5-yl)-4-decoxy-6-propan-2-yloxy-2H-chromene-3-carboxylate Openeye Name: methyl 2-(1,3-benzodioxol-5-yl)-4-decoxy-6-isopropoxy-2H-chromene-3-carboxylate CAS Name: 2-(1,3-benzodioxol-5-yl)-4-decoxy-6-propan-2-yloxy-2H-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(1,3-benzodioxol-5-yl)-4-decoxy-6-propan-2-yloxy-2H-chromene-3-carboxylate Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-decoxy-6-isopropoxy-2H-chromene-3-carboxylic acid methyl ester Formula: C31H40O7 MolecularWeight: 524.6451

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C(OC2=C1C=C(C=C2)OC(C)C)C3=CC4=C(C=C3)OCO4)C(=O)OC

Isomeric SMILES

CCCCCCCCCCOC1=C(C(OC2=C1C=C(C=C2)OC(C)C)C3=CC4=C(C=C3)OCO4)C(=O)OC

InChI

InChI=1S/C31H40O7/c1-5-6-7-8-9-10-11-12-17-34-30-24-19-23(37-21(2)3)14-16-25(24)38-29(28(30)31(32)33-4)22-13-15-26-27(18-22)36-20-35-26/h13-16,18-19,21,29H,5-12,17,20H2,1-4H3