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

Systemtic Name: propyl 1-methoxy-6,6-dimethyl-3-(2-methyloctan-2-yl)benzo[c]chromene-9-carboxylate Openeye Name: propyl 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 propyl ester IUPAC Name: propyl 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 propyl ester Formula: C29H40O4 MolecularWeight: 452.6255

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H40O4/c1-8-10-11-12-15-28(3,4)21-18-24(31-7)26-22-17-20(27(30)32-16-9-2)13-14-23(22)29(5,6)33-25(26)19-21/h13-14,17-19H,8-12,15-16H2,1-7H3