(5S)-2-(1H-indol-3-ylmethyl)-5-(4-methoxyphenyl)-3-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: (5S)-2-(1H-indol-3-ylmethyl)-5-(4-methoxyphenyl)-3-oxidanyl-cyclohex-2-en-1-one Openeye Name: (5S)-3-hydroxy-2-(1H-indol-3-ylmethyl)-5-(4-methoxyphenyl)cyclohex-2-en-1-one CAS Name: (5S)-3-hydroxy-2-(1H-indol-3-ylmethyl)-5-(4-methoxyphenyl)-1-cyclohex-2-enone IUPAC Name: (5S)-3-hydroxy-2-(1H-indol-3-ylmethyl)-5-(4-methoxyphenyl)cyclohex-2-en-1-one Traditional Name: (5S)-3-hydroxy-2-(1H-indol-3-ylmethyl)-5-(4-methoxyphenyl)cyclohex-2-en-1-one Formula: C22H21NO3 MolecularWeight: 347.40704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=C(C(=O)C2)CC3=CNC4=CC=CC=C43)O

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CC(=C(C(=O)C2)CC3=CNC4=CC=CC=C43)O

InChI

InChI=1S/C22H21NO3/c1-26-17-8-6-14(7-9-17)15-11-21(24)19(22(25)12-15)10-16-13-23-20-5-3-2-4-18(16)20/h2-9,13,15,23-24H,10-12H2,1H3/t15-/m0/s1