N-(4-aminocarbonylphenyl)-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide

Systemtic Name: N-(4-aminocarbonylphenyl)-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide Openeye Name: N-(4-carbamoylphenyl)-2-(3-isobutoxyphenyl)quinoline-4-carboxamide CAS Name: N-(4-carbamoylphenyl)-2-[3-(2-methylpropoxy)phenyl]-4-quinolinecarboxamide IUPAC Name: N-(4-carbamoylphenyl)-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide Traditional Name: N-(4-carbamoylphenyl)-2-(3-isobutoxyphenyl)cinchoninamide Formula: C27H25N3O3 MolecularWeight: 439.5057

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=C(C=C4)C(=O)N

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C27H25N3O3/c1-17(2)16-33-21-7-5-6-19(14-21)25-15-23(22-8-3-4-9-24(22)30-25)27(32)29-20-12-10-18(11-13-20)26(28)31/h3-15,17H,16H2,1-2H3,(H2,28,31)(H,29,32)