4a-(2-dimethylaminoethyl)-6-methoxy-5-oxidanyl-1,2,4,10a-tetrahydrophenanthren-3-one

Systemtic Name: 4a-(2-dimethylaminoethyl)-6-methoxy-5-oxidanyl-1,2,4,10a-tetrahydrophenanthren-3-one Openeye Name: 4a-(2-dimethylaminoethyl)-5-hydroxy-6-methoxy-1,2,4,10a-tetrahydrophenanthren-3-one CAS Name: 4a-(2-dimethylaminoethyl)-5-hydroxy-6-methoxy-1,2,4,10a-tetrahydrophenanthren-3-one IUPAC Name: 4a-(2-dimethylaminoethyl)-5-hydroxy-6-methoxy-1,2,4,10a-tetrahydrophenanthren-3-one Traditional Name: 4a-(2-dimethylaminoethyl)-5-hydroxy-6-methoxy-1,2,4,10a-tetrahydrophenanthren-3-one Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC12CC(=O)CCC1C=CC3=C2C(=C(C=C3)OC)O

Isomeric SMILES

CN(C)CCC12CC(=O)CCC1C=CC3=C2C(=C(C=C3)OC)O

InChI

InChI=1S/C19H25NO3/c1-20(2)11-10-19-12-15(21)8-7-14(19)6-4-13-5-9-16(23-3)18(22)17(13)19/h4-6,9,14,22H,7-8,10-12H2,1-3H3