2-methyl-N-(2-piperidin-1-ium-1-ylethyl)benzo[h]quinolin-1-ium-4-amine

Systemtic Name: 2-methyl-N-(2-piperidin-1-ium-1-ylethyl)benzo[h]quinolin-1-ium-4-amine Openeye Name: 2-methyl-N-(2-piperidin-1-ium-1-ylethyl)benzo[h]quinolin-1-ium-4-amine CAS Name: 2-methyl-N-[2-(1-piperidin-1-iumyl)ethyl]-4-benzo[h]quinolin-1-iumamine IUPAC Name: 2-methyl-N-(2-piperidin-1-ium-1-ylethyl)benzo[h]quinolin-1-ium-4-amine Traditional Name: (2-methylbenzo[h]quinolin-1-ium-4-yl)-(2-piperidin-1-ium-1-ylethyl)amine Formula: C21H27N3+2 MolecularWeight: 321.45918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C2=C(C=CC3=CC=CC=C32)C(=C1)NCC[NH+]4CCCCC4

Isomeric SMILES

CC1=[NH+]C2=C(C=CC3=CC=CC=C32)C(=C1)NCC[NH+]4CCCCC4

InChI

InChI=1S/C21H25N3/c1-16-15-20(22-11-14-24-12-5-2-6-13-24)19-10-9-17-7-3-4-8-18(17)21(19)23-16/h3-4,7-10,15H,2,5-6,11-14H2,1H3,(H,22,23)/p+2