1-(1H-indol-3-yl)-3-(4-methylphenyl)-2-oxidanyl-3-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: 1-(1H-indol-3-yl)-3-(4-methylphenyl)-2-oxidanyl-3-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: 2-hydroxy-1-(1H-indol-3-yl)-3-(4-phenylpiperazin-1-yl)-3-(p-tolyl)propan-1-one CAS Name: 2-hydroxy-1-(1H-indol-3-yl)-3-(4-methylphenyl)-3-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: 2-hydroxy-1-(1H-indol-3-yl)-3-(4-methylphenyl)-3-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: 2-hydroxy-1-(1H-indol-3-yl)-3-(4-phenylpiperazino)-3-(p-tolyl)propan-1-one Formula: C28H29N3O2 MolecularWeight: 439.54876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(C(=O)C2=CNC3=CC=CC=C32)O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C(C(C(=O)C2=CNC3=CC=CC=C32)O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C28H29N3O2/c1-20-11-13-21(14-12-20)26(31-17-15-30(16-18-31)22-7-3-2-4-8-22)28(33)27(32)24-19-29-25-10-6-5-9-23(24)25/h2-14,19,26,28-29,33H,15-18H2,1H3