2-(2-methylpropyl)-7-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]-3,4-dihydrochromene-2-carboxylic acid

Systemtic Name: 2-(2-methylpropyl)-7-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]-3,4-dihydrochromene-2-carboxylic acid Openeye Name: 2-isobutyl-7-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]chromane-2-carboxylic acid CAS Name: 2-(2-methylpropyl)-7-[3-(4-phenoxy-2-propylphenoxy)propoxy]-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid IUPAC Name: 2-(2-methylpropyl)-7-[3-(4-phenoxy-2-propylphenoxy)propoxy]-3,4-dihydrochromene-2-carboxylic acid Traditional Name: 2-isobutyl-7-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]chroman-2-carboxylic acid Formula: C32H38O6 MolecularWeight: 518.64052

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)OC2=CC=CC=C2)OCCCOC3=CC4=C(CCC(O4)(CC(C)C)C(=O)O)C=C3

Isomeric SMILES

CCCC1=C(C=CC(=C1)OC2=CC=CC=C2)OCCCOC3=CC4=C(CCC(O4)(CC(C)C)C(=O)O)C=C3

InChI

InChI=1S/C32H38O6/c1-4-9-25-20-28(37-26-10-6-5-7-11-26)14-15-29(25)36-19-8-18-35-27-13-12-24-16-17-32(31(33)34,22-23(2)3)38-30(24)21-27/h5-7,10-15,20-21,23H,4,8-9,16-19,22H2,1-3H3,(H,33,34)