N-butan-2-yl-2-[(2-methylphenyl)amino]quinoline-4-carboxamide

Systemtic Name: N-butan-2-yl-2-[(2-methylphenyl)amino]quinoline-4-carboxamide Openeye Name: 2-(2-methylanilino)-N-sec-butyl-quinoline-4-carboxamide CAS Name: N-butan-2-yl-2-(2-methylanilino)-4-quinolinecarboxamide IUPAC Name: N-butan-2-yl-2-(2-methylanilino)quinoline-4-carboxamide Traditional Name: 2-(o-toluidino)-N-sec-butyl-cinchoninamide Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=NC2=CC=CC=C21)NC3=CC=CC=C3C

Isomeric SMILES

CCC(C)NC(=O)C1=CC(=NC2=CC=CC=C21)NC3=CC=CC=C3C

InChI

InChI=1S/C21H23N3O/c1-4-15(3)22-21(25)17-13-20(23-18-11-7-5-9-14(18)2)24-19-12-8-6-10-16(17)19/h5-13,15H,4H2,1-3H3,(H,22,25)(H,23,24)