N-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]-1-(4-propan-2-ylphenyl)methanimine

Systemtic Name: N-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]-1-(4-propan-2-ylphenyl)methanimine Openeye Name: 1-(4-isopropylphenyl)-N-[4-(p-tolylmethyl)piperazin-4-ium-1-yl]methanimine CAS Name: N-[4-[(4-methylphenyl)methyl]-1-piperazin-4-iumyl]-1-(4-propan-2-ylphenyl)methanimine IUPAC Name: N-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]-1-(4-propan-2-ylphenyl)methanimine Traditional Name: (E)-(4-isopropylbenzylidene)-[4-(4-methylbenzyl)piperazin-4-ium-1-yl]amine Formula: C22H30N3+ MolecularWeight: 336.4937

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)N=CC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)/N=C/C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C22H29N3/c1-18(2)22-10-8-20(9-11-22)16-23-25-14-12-24(13-15-25)17-21-6-4-19(3)5-7-21/h4-11,16,18H,12-15,17H2,1-3H3/p+1/b23-16+