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

Systemtic Name: [4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]methylazanium Openeye Name: [4-(4-benzylpiperazin-4-ium-1-yl)phenyl]methylammonium CAS Name: [4-[4-(phenylmethyl)-1-piperazin-4-iumyl]phenyl]methylammonium IUPAC Name: [4-(4-benzylpiperazin-4-ium-1-yl)phenyl]methylazanium Traditional Name: [4-(4-benzylpiperazin-4-ium-1-yl)benzyl]ammonium Formula: C18H25N3+2 MolecularWeight: 283.4112

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)C[NH3+]

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)C[NH3+]

InChI

InChI=1S/C18H23N3/c19-14-16-6-8-18(9-7-16)21-12-10-20(11-13-21)15-17-4-2-1-3-5-17/h1-9H,10-15,19H2/p+2