N4-methyl-N4-[2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]benzene-1,4-diamine

Systemtic Name: N4-methyl-N4-[2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]benzene-1,4-diamine Openeye Name: N4-methyl-N4-[2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]benzene-1,4-diamine CAS Name: N4-methyl-N4-[2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]benzene-1,4-diamine IUPAC Name: 4-N-methyl-4-N-[2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]benzene-1,4-diamine Traditional Name: (4-aminophenyl)-methyl-[2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]amine Formula: C18H24N3+ MolecularWeight: 282.40326

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC[NH+]1CCC2=CC=CC=C2C1)C3=CC=C(C=C3)N

Isomeric SMILES

CN(CC[NH+]1CCC2=CC=CC=C2C1)C3=CC=C(C=C3)N

InChI

InChI=1S/C18H23N3/c1-20(18-8-6-17(19)7-9-18)12-13-21-11-10-15-4-2-3-5-16(15)14-21/h2-9H,10-14,19H2,1H3/p+1