1-[1-(3-methoxy-4-oxidanyl-phenyl)-4a-oxidanyl-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-3-phenyl-propan-1-one

Systemtic Name: 1-[1-(3-methoxy-4-oxidanyl-phenyl)-4a-oxidanyl-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-3-phenyl-propan-1-one Openeye Name: 1-[4a-hydroxy-1-(4-hydroxy-3-methoxy-phenyl)-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-3-phenyl-propan-1-one CAS Name: 1-[4a-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-3-phenyl-1-propanone IUPAC Name: 1-[4a-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-3-phenylpropan-1-one Traditional Name: 1-[4a-hydroxy-1-(4-hydroxy-3-methoxy-phenyl)-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-3-phenyl-propan-1-one Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C3CCCCC3(CCN2C(=O)CCC4=CC=CC=C4)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C2C3CCCCC3(CCN2C(=O)CCC4=CC=CC=C4)O)O

InChI

InChI=1S/C25H31NO4/c1-30-22-17-19(11-12-21(22)27)24-20-9-5-6-14-25(20,29)15-16-26(24)23(28)13-10-18-7-3-2-4-8-18/h2-4,7-8,11-12,17,20,24,27,29H,5-6,9-10,13-16H2,1H3