6-methoxy-1,1,4a,7-tetramethyl-2-phenylsulfanyl-3,4,10,10a-tetrahydro-2H-phenanthren-9-one

Systemtic Name: 6-methoxy-1,1,4a,7-tetramethyl-2-phenylsulfanyl-3,4,10,10a-tetrahydro-2H-phenanthren-9-one Openeye Name: 6-methoxy-1,1,4a,7-tetramethyl-2-phenylsulfanyl-3,4,10,10a-tetrahydro-2H-phenanthren-9-one CAS Name: 6-methoxy-1,1,4a,7-tetramethyl-2-(phenylthio)-3,4,10,10a-tetrahydro-2H-phenanthren-9-one IUPAC Name: 6-methoxy-1,1,4a,7-tetramethyl-2-phenylsulfanyl-3,4,10,10a-tetrahydro-2H-phenanthren-9-one Traditional Name: 6-methoxy-1,1,4a,7-tetramethyl-2-(phenylthio)-3,4,10,10a-tetrahydro-2H-phenanthren-9-one Formula: C25H30O2S MolecularWeight: 394.5695

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)CC3C2(CCC(C3(C)C)SC4=CC=CC=C4)C)OC

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)CC3C2(CCC(C3(C)C)SC4=CC=CC=C4)C)OC

InChI

InChI=1S/C25H30O2S/c1-16-13-18-19(14-21(16)27-5)25(4)12-11-23(28-17-9-7-6-8-10-17)24(2,3)22(25)15-20(18)26/h6-10,13-14,22-23H,11-12,15H2,1-5H3