hexyl 1-methoxy-6,6-dimethyl-3-(2-methyloctan-2-yl)benzo[c]chromene-9-carboxylate

Systemtic Name: hexyl 1-methoxy-6,6-dimethyl-3-(2-methyloctan-2-yl)benzo[c]chromene-9-carboxylate Openeye Name: hexyl 3-(1,1-dimethylheptyl)-1-methoxy-6,6-dimethyl-benzo[c]chromene-9-carboxylate CAS Name: 1-methoxy-6,6-dimethyl-3-(2-methyloctan-2-yl)-9-benzo[c][1]benzopyrancarboxylic acid hexyl ester IUPAC Name: hexyl 1-methoxy-6,6-dimethyl-3-(2-methyloctan-2-yl)benzo[c]chromene-9-carboxylate Traditional Name: 3-(1,1-dimethylheptyl)-1-methoxy-6,6-dimethyl-benzo[c]chromene-9-carboxylic acid hexyl ester Formula: C32H46O4 MolecularWeight: 494.70524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC2=C(C(=C1)OC)C3=C(C=CC(=C3)C(=O)OCCCCCC)C(O2)(C)C

Isomeric SMILES

CCCCCCC(C)(C)C1=CC2=C(C(=C1)OC)C3=C(C=CC(=C3)C(=O)OCCCCCC)C(O2)(C)C

InChI

InChI=1S/C32H46O4/c1-8-10-12-14-18-31(3,4)24-21-27(34-7)29-25-20-23(30(33)35-19-15-13-11-9-2)16-17-26(25)32(5,6)36-28(29)22-24/h16-17,20-22H,8-15,18-19H2,1-7H3