4a-ethyl-3-methyl-7-[(2-methylpyridin-3-yl)methoxy]-2-phenyl-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3-diol

Systemtic Name: 4a-ethyl-3-methyl-7-[(2-methylpyridin-3-yl)methoxy]-2-phenyl-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3-diol Openeye Name: 4a-ethyl-3-methyl-7-[(2-methyl-3-pyridyl)methoxy]-2-phenyl-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3-diol CAS Name: 4a-ethyl-3-methyl-7-[(2-methyl-3-pyridinyl)methoxy]-2-phenyl-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3-diol IUPAC Name: 4a-ethyl-3-methyl-7-[(2-methylpyridin-3-yl)methoxy]-2-phenyl-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3-diol Traditional Name: 4a-ethyl-3-methyl-7-[(2-methyl-3-pyridyl)methoxy]-2-phenyl-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3-diol Formula: C30H35NO3 MolecularWeight: 457.6038

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Descriptors Computed from Structure

Canonical SMILES:

CCC12CC(C(CC1CCC3=C2C=CC(=C3)OCC4=C(N=CC=C4)C)(C5=CC=CC=C5)O)(C)O

Isomeric SMILES

CCC12CC(C(CC1CCC3=C2C=CC(=C3)OCC4=C(N=CC=C4)C)(C5=CC=CC=C5)O)(C)O

InChI

InChI=1S/C30H35NO3/c1-4-29-20-28(3,32)30(33,24-10-6-5-7-11-24)18-25(29)13-12-22-17-26(14-15-27(22)29)34-19-23-9-8-16-31-21(23)2/h5-11,14-17,25,32-33H,4,12-13,18-20H2,1-3H3