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

Systemtic Name: [4-[4-[2-(cyclohexen-1-yl)ethyl]piperazin-4-ium-1-yl]phenyl]methylazanium Openeye Name: [4-[4-[2-(cyclohexen-1-yl)ethyl]piperazin-4-ium-1-yl]phenyl]methylammonium CAS Name: [4-[4-[2-(1-cyclohexenyl)ethyl]-1-piperazin-4-iumyl]phenyl]methylammonium IUPAC Name: [4-[4-[2-(cyclohexen-1-yl)ethyl]piperazin-4-ium-1-yl]phenyl]methylazanium Traditional Name: [4-[4-[2-(cyclohexen-1-yl)ethyl]piperazin-4-ium-1-yl]benzyl]ammonium Formula: C19H31N3+2 MolecularWeight: 301.46954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29N3/c20-16-18-6-8-19(9-7-18)22-14-12-21(13-15-22)11-10-17-4-2-1-3-5-17/h4,6-9H,1-3,5,10-16,20H2/p+2