N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-2-(4-methylphenyl)quinoline-4-carboxamide

Systemtic Name: N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-2-(4-methylphenyl)quinoline-4-carboxamide Openeye Name: N-[2-(2,6-dimethylanilino)-2-oxo-ethyl]-2-(p-tolyl)quinoline-4-carboxamide CAS Name: N-[2-(2,6-dimethylanilino)-2-oxoethyl]-2-(4-methylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[2-(2,6-dimethylanilino)-2-oxoethyl]-2-(4-methylphenyl)quinoline-4-carboxamide Traditional Name: N-[2-(2,6-dimethylanilino)-2-keto-ethyl]-2-(p-tolyl)cinchoninamide Formula: C27H25N3O2 MolecularWeight: 423.5063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC(=O)NC4=C(C=CC=C4C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC(=O)NC4=C(C=CC=C4C)C

InChI

InChI=1S/C27H25N3O2/c1-17-11-13-20(14-12-17)24-15-22(21-9-4-5-10-23(21)29-24)27(32)28-16-25(31)30-26-18(2)7-6-8-19(26)3/h4-15H,16H2,1-3H3,(H,28,32)(H,30,31)