2-cyclopropyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-3-yl]quinoline-4-carboxamide

Systemtic Name: 2-cyclopropyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-3-yl]quinoline-4-carboxamide Openeye Name: 2-cyclopropyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)-3-piperidyl]quinoline-4-carboxamide CAS Name: 2-cyclopropyl-N-[(3S)-1-(1-methyl-4-piperidin-1-iumyl)-3-piperidinyl]-4-quinolinecarboxamide IUPAC Name: 2-cyclopropyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-3-yl]quinoline-4-carboxamide Traditional Name: 2-cyclopropyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)-3-piperidyl]cinchoninamide Formula: C24H33N4O+ MolecularWeight: 393.54502

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N2CCCC(C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5CC5

Isomeric SMILES

C[NH+]1CCC(CC1)N2CCC[C@@H](C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5CC5

InChI

InChI=1S/C24H32N4O/c1-27-13-10-19(11-14-27)28-12-4-5-18(16-28)25-24(29)21-15-23(17-8-9-17)26-22-7-3-2-6-20(21)22/h2-3,6-7,15,17-19H,4-5,8-14,16H2,1H3,(H,25,29)/p+1/t18-/m0/s1