4a-ethyl-3-methyl-2-(4-methylphenyl)-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol

Systemtic Name: 4a-ethyl-3-methyl-2-(4-methylphenyl)-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol Openeye Name: 4a-ethyl-3-methyl-2-(p-tolyl)-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol CAS Name: 4a-ethyl-3-methyl-2-(4-methylphenyl)-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol IUPAC Name: 4a-ethyl-3-methyl-2-(4-methylphenyl)-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol Traditional Name: 4a-ethyl-3-methyl-2-(p-tolyl)-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol Formula: C24H30O3 MolecularWeight: 366.4932

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Descriptors Computed from Structure

Canonical SMILES:

CCC12CC(C(CC1CCC3=C2C=CC(=C3)O)(C4=CC=C(C=C4)C)O)(C)O

Isomeric SMILES

CCC12CC(C(CC1CCC3=C2C=CC(=C3)O)(C4=CC=C(C=C4)C)O)(C)O

InChI

InChI=1S/C24H30O3/c1-4-23-15-22(3,26)24(27,18-8-5-16(2)6-9-18)14-19(23)10-7-17-13-20(25)11-12-21(17)23/h5-6,8-9,11-13,19,25-27H,4,7,10,14-15H2,1-3H3