N-[(3-methylphenyl)methyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide

Systemtic Name: N-[(3-methylphenyl)methyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide Openeye Name: N-(m-tolylmethyl)-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide CAS Name: N-[(3-methylphenyl)methyl]-2-[4-(1-oxopropylamino)phenyl]-4-quinolinecarboxamide IUPAC Name: N-[(3-methylphenyl)methyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide Traditional Name: N-(3-methylbenzyl)-2-(4-propionamidophenyl)cinchoninamide Formula: C27H25N3O2 MolecularWeight: 423.5063

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=CC(=C4)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=CC(=C4)C

InChI

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