(4aS,10aR)-1-(4-methylphenyl)-4a,9,10,10a-tetrahydro-4H-phenanthren-3-one

Systemtic Name: (4aS,10aR)-1-(4-methylphenyl)-4a,9,10,10a-tetrahydro-4H-phenanthren-3-one Openeye Name: (4aS,10aR)-1-(p-tolyl)-4a,9,10,10a-tetrahydro-4H-phenanthren-3-one CAS Name: (4aS,10aR)-1-(4-methylphenyl)-4a,9,10,10a-tetrahydro-4H-phenanthren-3-one IUPAC Name: (4aS,10aR)-1-(4-methylphenyl)-4a,9,10,10a-tetrahydro-4H-phenanthren-3-one Traditional Name: (4aS,10aR)-1-(p-tolyl)-4a,9,10,10a-tetrahydro-4H-phenanthren-3-one Formula: C21H20O MolecularWeight: 288.3829

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=O)CC3C2CCC4=CC=CC=C34

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=O)C[C@H]3[C@H]2CCC4=CC=CC=C34

InChI

InChI=1S/C21H20O/c1-14-6-8-16(9-7-14)20-12-17(22)13-21-18-5-3-2-4-15(18)10-11-19(20)21/h2-9,12,19,21H,10-11,13H2,1H3/t19-,21+/m0/s1