[2-[4-(cyclohexylmethyl)piperazin-4-ium-1-yl]phenyl]methylazanium

Systemtic Name: [2-[4-(cyclohexylmethyl)piperazin-4-ium-1-yl]phenyl]methylazanium Openeye Name: [2-[4-(cyclohexylmethyl)piperazin-4-ium-1-yl]phenyl]methylammonium CAS Name: [2-[4-(cyclohexylmethyl)-1-piperazin-4-iumyl]phenyl]methylammonium IUPAC Name: [2-[4-(cyclohexylmethyl)piperazin-4-ium-1-yl]phenyl]methylazanium Traditional Name: [2-[4-(cyclohexylmethyl)piperazin-4-ium-1-yl]benzyl]ammonium Formula: C18H31N3+2 MolecularWeight: 289.45884

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C[NH+]2CCN(CC2)C3=CC=CC=C3C[NH3+]

Isomeric SMILES

C1CCC(CC1)C[NH+]2CCN(CC2)C3=CC=CC=C3C[NH3+]

InChI

InChI=1S/C18H29N3/c19-14-17-8-4-5-9-18(17)21-12-10-20(11-13-21)15-16-6-2-1-3-7-16/h4-5,8-9,16H,1-3,6-7,10-15,19H2/p+2