[4-(3-oxidanylpropyl)piperazin-4-ium-1-yl]-(4-propan-2-ylphenyl)methanone

Systemtic Name: [4-(3-oxidanylpropyl)piperazin-4-ium-1-yl]-(4-propan-2-ylphenyl)methanone Openeye Name: [4-(3-hydroxypropyl)piperazin-4-ium-1-yl]-(4-isopropylphenyl)methanone CAS Name: [4-(3-hydroxypropyl)-1-piperazin-4-iumyl]-(4-propan-2-ylphenyl)methanone IUPAC Name: [4-(3-hydroxypropyl)piperazin-4-ium-1-yl]-(4-propan-2-ylphenyl)methanone Traditional Name: [4-(3-hydroxypropyl)piperazin-4-ium-1-yl]-p-cumenyl-methanone Formula: C17H27N2O2+ MolecularWeight: 291.40848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CCCO

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CCCO

InChI

InChI=1S/C17H26N2O2/c1-14(2)15-4-6-16(7-5-15)17(21)19-11-9-18(10-12-19)8-3-13-20/h4-7,14,20H,3,8-13H2,1-2H3/p+1