4-(1H-indol-4-yl)-2-phenyl-1-piperazin-1-yl-butan-1-one

Systemtic Name: 4-(1H-indol-4-yl)-2-phenyl-1-piperazin-1-yl-butan-1-one Openeye Name: 4-(1H-indol-4-yl)-2-phenyl-1-piperazin-1-yl-butan-1-one CAS Name: 4-(1H-indol-4-yl)-2-phenyl-1-(1-piperazinyl)-1-butanone IUPAC Name: 4-(1H-indol-4-yl)-2-phenyl-1-piperazin-1-ylbutan-1-one Traditional Name: 4-(1H-indol-4-yl)-2-phenyl-1-piperazino-butan-1-one Formula: C22H25N3O MolecularWeight: 347.4534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C(CCC2=C3C=CNC3=CC=C2)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1)C(=O)C(CCC2=C3C=CNC3=CC=C2)C4=CC=CC=C4

InChI

InChI=1S/C22H25N3O/c26-22(25-15-13-23-14-16-25)20(17-5-2-1-3-6-17)10-9-18-7-4-8-21-19(18)11-12-24-21/h1-8,11-12,20,23-24H,9-10,13-16H2