2-[[4-(4-phenylbutyl)piperazin-1-yl]methyl]chromen-4-one

Systemtic Name: 2-[[4-(4-phenylbutyl)piperazin-1-yl]methyl]chromen-4-one Openeye Name: 2-[[4-(4-phenylbutyl)piperazin-1-yl]methyl]chromen-4-one CAS Name: 2-[[4-(4-phenylbutyl)-1-piperazinyl]methyl]-1-benzopyran-4-one IUPAC Name: 2-[[4-(4-phenylbutyl)piperazin-1-yl]methyl]chromen-4-one Traditional Name: 2-[[4-(4-phenylbutyl)piperazino]methyl]chromone Formula: C24H28N2O2 MolecularWeight: 376.49132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2=CC=CC=C2)CC3=CC(=O)C4=CC=CC=C4O3

Isomeric SMILES

C1CN(CCN1CCCCC2=CC=CC=C2)CC3=CC(=O)C4=CC=CC=C4O3

InChI

InChI=1S/C24H28N2O2/c27-23-18-21(28-24-12-5-4-11-22(23)24)19-26-16-14-25(15-17-26)13-7-6-10-20-8-2-1-3-9-20/h1-5,8-9,11-12,18H,6-7,10,13-17,19H2