2-(4-chlorophenyl)-N-[(1-ethylpiperidin-1-ium-4-ylidene)amino]quinoline-4-carboxamide

Systemtic Name: 2-(4-chlorophenyl)-N-[(1-ethylpiperidin-1-ium-4-ylidene)amino]quinoline-4-carboxamide Openeye Name: 2-(4-chlorophenyl)-N-[(1-ethylpiperidin-1-ium-4-ylidene)amino]quinoline-4-carboxamide CAS Name: 2-(4-chlorophenyl)-N-[(1-ethyl-4-piperidin-1-iumylidene)amino]-4-quinolinecarboxamide IUPAC Name: 2-(4-chlorophenyl)-N-[(1-ethylpiperidin-1-ium-4-ylidene)amino]quinoline-4-carboxamide Traditional Name: 2-(4-chlorophenyl)-N-[(1-ethylpiperidin-1-ium-4-ylidene)amino]cinchoninamide Formula: C23H24ClN4O+ MolecularWeight: 407.91586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23ClN4O/c1-2-28-13-11-18(12-14-28)26-27-23(29)20-15-22(16-7-9-17(24)10-8-16)25-21-6-4-3-5-19(20)21/h3-10,15H,2,11-14H2,1H3,(H,27,29)/p+1