(6,6-dimethyl-3-octan-2-yl-9-oxidanylidene-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-1-yl) propanoate

Systemtic Name: (6,6-dimethyl-3-octan-2-yl-9-oxidanylidene-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-1-yl) propanoate Openeye Name: [6,6-dimethyl-3-(1-methylheptyl)-9-oxo-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-1-yl] propanoate CAS Name: propanoic acid (6,6-dimethyl-3-octan-2-yl-9-oxo-7,8,10,10a-tetrahydro-6aH-benzo[c][1]benzopyran-1-yl) ester IUPAC Name: (6,6-dimethyl-3-octan-2-yl-9-oxo-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-1-yl) propanoate Traditional Name: propionic acid [9-keto-6,6-dimethyl-3-(1-methylheptyl)-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-1-yl] ester Formula: C26H38O4 MolecularWeight: 414.57752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)C1=CC2=C(C3CC(=O)CCC3C(O2)(C)C)C(=C1)OC(=O)CC

Isomeric SMILES

CCCCCCC(C)C1=CC2=C(C3CC(=O)CCC3C(O2)(C)C)C(=C1)OC(=O)CC

InChI

InChI=1S/C26H38O4/c1-6-8-9-10-11-17(3)18-14-22(29-24(28)7-2)25-20-16-19(27)12-13-21(20)26(4,5)30-23(25)15-18/h14-15,17,20-21H,6-13,16H2,1-5H3