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

Systemtic Name: N-[(2-methoxyphenyl)methyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide Openeye Name: N-[(2-methoxyphenyl)methyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide CAS Name: N-[(2-methoxyphenyl)methyl]-2-[4-(1-oxopropylamino)phenyl]-4-quinolinecarboxamide IUPAC Name: N-[(2-methoxyphenyl)methyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide Traditional Name: N-o-anisyl-2-(4-propionamidophenyl)cinchoninamide Formula: C27H25N3O3 MolecularWeight: 439.5057

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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=C4OC

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=CC=C4OC

InChI

InChI=1S/C27H25N3O3/c1-3-26(31)29-20-14-12-18(13-15-20)24-16-22(21-9-5-6-10-23(21)30-24)27(32)28-17-19-8-4-7-11-25(19)33-2/h4-16H,3,17H2,1-2H3,(H,28,32)(H,29,31)