4-(hydroxymethyl)-2-oxidanyl-3-[1-(phenylmethyl)indol-3-yl]cyclopent-2-en-1-one

Systemtic Name: 4-(hydroxymethyl)-2-oxidanyl-3-[1-(phenylmethyl)indol-3-yl]cyclopent-2-en-1-one Openeye Name: 3-(1-benzylindol-3-yl)-2-hydroxy-4-(hydroxymethyl)cyclopent-2-en-1-one CAS Name: 2-hydroxy-4-(hydroxymethyl)-3-[1-(phenylmethyl)-3-indolyl]-1-cyclopent-2-enone IUPAC Name: 3-(1-benzylindol-3-yl)-2-hydroxy-4-(hydroxymethyl)cyclopent-2-en-1-one Traditional Name: 3-(1-benzylindol-3-yl)-2-hydroxy-4-methylol-cyclopent-2-en-1-one Formula: C21H19NO3 MolecularWeight: 333.38046

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=C(C1=O)O)C2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)CO

Isomeric SMILES

C1C(C(=C(C1=O)O)C2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)CO

InChI

InChI=1S/C21H19NO3/c23-13-15-10-19(24)21(25)20(15)17-12-22(11-14-6-2-1-3-7-14)18-9-5-4-8-16(17)18/h1-9,12,15,23,25H,10-11,13H2