[1-[3-[(4-methylpiperazin-4-ium-1-yl)methyl]phenyl]carbonylpiperidin-4-yl]azanium

Systemtic Name: [1-[3-[(4-methylpiperazin-4-ium-1-yl)methyl]phenyl]carbonylpiperidin-4-yl]azanium Openeye Name: [1-[3-[(4-methylpiperazin-4-ium-1-yl)methyl]benzoyl]-4-piperidyl]ammonium CAS Name: [1-[[3-[(4-methyl-1-piperazin-4-iumyl)methyl]phenyl]-oxomethyl]-4-piperidinyl]ammonium IUPAC Name: [1-[3-[(4-methylpiperazin-4-ium-1-yl)methyl]benzoyl]piperidin-4-yl]azanium Traditional Name: [1-[3-[(4-methylpiperazin-4-ium-1-yl)methyl]benzoyl]-4-piperidyl]ammonium Formula: C18H30N4O+2 MolecularWeight: 318.457

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CC2=CC=CC(=C2)C(=O)N3CCC(CC3)[NH3+]

Isomeric SMILES

C[NH+]1CCN(CC1)CC2=CC=CC(=C2)C(=O)N3CCC(CC3)[NH3+]

InChI

InChI=1S/C18H28N4O/c1-20-9-11-21(12-10-20)14-15-3-2-4-16(13-15)18(23)22-7-5-17(19)6-8-22/h2-4,13,17H,5-12,14,19H2,1H3/p+2