N-methyl-6-(propan-2-ylamino)-N-(quinolin-2-ylmethyl)pyridin-1-ium-3-carboxamide

Systemtic Name: N-methyl-6-(propan-2-ylamino)-N-(quinolin-2-ylmethyl)pyridin-1-ium-3-carboxamide Openeye Name: 6-(isopropylamino)-N-methyl-N-(2-quinolylmethyl)pyridin-1-ium-3-carboxamide CAS Name: N-methyl-6-(propan-2-ylamino)-N-(2-quinolinylmethyl)-3-pyridin-1-iumcarboxamide IUPAC Name: N-methyl-6-(propan-2-ylamino)-N-(quinolin-2-ylmethyl)pyridin-1-ium-3-carboxamide Traditional Name: 6-(isopropylamino)-N-methyl-N-(2-quinolylmethyl)pyridin-1-ium-3-carboxamide Formula: C20H23N4O+ MolecularWeight: 335.42282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=[NH+]C=C(C=C1)C(=O)N(C)CC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)NC1=[NH+]C=C(C=C1)C(=O)N(C)CC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H22N4O/c1-14(2)22-19-11-9-16(12-21-19)20(25)24(3)13-17-10-8-15-6-4-5-7-18(15)23-17/h4-12,14H,13H2,1-3H3,(H,21,22)/p+1