2-(4b,8,8-trimethyl-4-oxidanyl-3-oxidanylidene-6,7-dihydro-5H-phenanthren-2-yl)propyl 3-methoxy-4-oxidanyl-benzoate

Systemtic Name: 2-(4b,8,8-trimethyl-4-oxidanyl-3-oxidanylidene-6,7-dihydro-5H-phenanthren-2-yl)propyl 3-methoxy-4-oxidanyl-benzoate Openeye Name: 2-(4-hydroxy-4b,8,8-trimethyl-3-oxo-6,7-dihydro-5H-phenanthren-2-yl)propyl 4-hydroxy-3-methoxy-benzoate CAS Name: 4-hydroxy-3-methoxybenzoic acid 2-(4-hydroxy-4b,8,8-trimethyl-3-oxo-6,7-dihydro-5H-phenanthren-2-yl)propyl ester IUPAC Name: 2-(4-hydroxy-4b,8,8-trimethyl-3-oxo-6,7-dihydro-5H-phenanthren-2-yl)propyl 4-hydroxy-3-methoxybenzoate Traditional Name: 4-hydroxy-3-methoxy-benzoic acid 2-(4-hydroxy-3-keto-4b,8,8-trimethyl-6,7-dihydro-5H-phenanthren-2-yl)propyl ester Formula: C28H32O6 MolecularWeight: 464.55008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)C1=CC(=C(C=C1)O)OC)C2=CC3=CC=C4C(CCCC4(C3=C(C2=O)O)C)(C)C

Isomeric SMILES

CC(COC(=O)C1=CC(=C(C=C1)O)OC)C2=CC3=CC=C4C(CCCC4(C3=C(C2=O)O)C)(C)C

InChI

InChI=1S/C28H32O6/c1-16(15-34-26(32)18-7-9-20(29)21(14-18)33-5)19-13-17-8-10-22-27(2,3)11-6-12-28(22,4)23(17)25(31)24(19)30/h7-10,13-14,16,29,31H,6,11-12,15H2,1-5H3