5-methyl-1-oxidanyl-3-(5-phenylpentan-2-yloxy)-6,6a,7,8-tetrahydrophenanthridin-9-one

Systemtic Name: 5-methyl-1-oxidanyl-3-(5-phenylpentan-2-yloxy)-6,6a,7,8-tetrahydrophenanthridin-9-one Openeye Name: 1-hydroxy-5-methyl-3-(1-methyl-4-phenyl-butoxy)-6,6a,7,8-tetrahydrophenanthridin-9-one CAS Name: 1-hydroxy-5-methyl-3-(5-phenylpentan-2-yloxy)-6,6a,7,8-tetrahydrophenanthridin-9-one IUPAC Name: 1-hydroxy-5-methyl-3-(5-phenylpentan-2-yloxy)-6,6a,7,8-tetrahydrophenanthridin-9-one Traditional Name: 1-hydroxy-5-methyl-3-(1-methyl-4-phenyl-butoxy)-6,6a,7,8-tetrahydrophenanthridin-9-one Formula: C25H29NO3 MolecularWeight: 391.50266

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1=CC=CC=C1)OC2=CC(=C3C4=CC(=O)CCC4CN(C3=C2)C)O

Isomeric SMILES

CC(CCCC1=CC=CC=C1)OC2=CC(=C3C4=CC(=O)CCC4CN(C3=C2)C)O

InChI

InChI=1S/C25H29NO3/c1-17(7-6-10-18-8-4-3-5-9-18)29-21-14-23-25(24(28)15-21)22-13-20(27)12-11-19(22)16-26(23)2/h3-5,8-9,13-15,17,19,28H,6-7,10-12,16H2,1-2H3