2-(3,4-dimethoxyphenyl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)quinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)quinoline-4-carboxamide Openeye Name: 2-(3,4-dimethoxyphenyl)-N-(1-isopropylpiperidin-1-ium-4-yl)quinoline-4-carboxamide CAS Name: 2-(3,4-dimethoxyphenyl)-N-(1-propan-2-yl-4-piperidin-1-iumyl)-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)quinoline-4-carboxamide Traditional Name: 2-(3,4-dimethoxyphenyl)-N-(1-isopropylpiperidin-1-ium-4-yl)cinchoninamide Formula: C26H32N3O3+ MolecularWeight: 434.55058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C26H31N3O3/c1-17(2)29-13-11-19(12-14-29)27-26(30)21-16-23(28-22-8-6-5-7-20(21)22)18-9-10-24(31-3)25(15-18)32-4/h5-10,15-17,19H,11-14H2,1-4H3,(H,27,30)/p+1