2-(3,4-dimethylphenyl)-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]quinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]quinoline-4-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]quinoline-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-N-[(1-methyl-4-piperidin-1-iumylidene)amino]-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]quinoline-4-carboxamide Traditional Name: 2-(3,4-dimethylphenyl)-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]cinchoninamide Formula: C24H27N4O+ MolecularWeight: 387.49738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NN=C4CC[NH+](CC4)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NN=C4CC[NH+](CC4)C)C

InChI

InChI=1S/C24H26N4O/c1-16-8-9-18(14-17(16)2)23-15-21(20-6-4-5-7-22(20)25-23)24(29)27-26-19-10-12-28(3)13-11-19/h4-9,14-15H,10-13H2,1-3H3,(H,27,29)/p+1