2-[[4-(3-phenylpropyl)piperazin-1-yl]methyl]chromen-4-one

Systemtic Name: 2-[[4-(3-phenylpropyl)piperazin-1-yl]methyl]chromen-4-one Openeye Name: 2-[[4-(3-phenylpropyl)piperazin-1-yl]methyl]chromen-4-one CAS Name: 2-[[4-(3-phenylpropyl)-1-piperazinyl]methyl]-1-benzopyran-4-one IUPAC Name: 2-[[4-(3-phenylpropyl)piperazin-1-yl]methyl]chromen-4-one Traditional Name: 2-[[4-(3-phenylpropyl)piperazino]methyl]chromone Formula: C23H26N2O2 MolecularWeight: 362.46474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2=CC=CC=C2)CC3=CC(=O)C4=CC=CC=C4O3

Isomeric SMILES

C1CN(CCN1CCCC2=CC=CC=C2)CC3=CC(=O)C4=CC=CC=C4O3

InChI

InChI=1S/C23H26N2O2/c26-22-17-20(27-23-11-5-4-10-21(22)23)18-25-15-13-24(14-16-25)12-6-9-19-7-2-1-3-8-19/h1-5,7-8,10-11,17H,6,9,12-16,18H2