N-(4-methyl-2-piperidin-1-yl-quinolin-1-ium-6-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-(4-methyl-2-piperidin-1-yl-quinolin-1-ium-6-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[4-methyl-2-(1-piperidyl)quinolin-1-ium-6-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[4-methyl-2-(1-piperidinyl)-6-quinolin-1-iumyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-(4-methyl-2-piperidin-1-ylquinolin-1-ium-6-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-(4-methyl-2-piperidino-quinolin-1-ium-6-yl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C24H26N3O3+ MolecularWeight: 404.48154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=C1C=C(C=C2)NC(=O)C3COC4=CC=CC=C4O3)N5CCCCC5

Isomeric SMILES

CC1=CC(=[NH+]C2=C1C=C(C=C2)NC(=O)C3COC4=CC=CC=C4O3)N5CCCCC5

InChI

InChI=1S/C24H25N3O3/c1-16-13-23(27-11-5-2-6-12-27)26-19-10-9-17(14-18(16)19)25-24(28)22-15-29-20-7-3-4-8-21(20)30-22/h3-4,7-10,13-14,22H,2,5-6,11-12,15H2,1H3,(H,25,28)/p+1