2-(1,3-benzodioxol-5-yl)-N-(2-ethanoylphenyl)quinoline-4-carboxamide hydrochloride

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-(2-ethanoylphenyl)quinoline-4-carboxamide hydrochloride Openeye Name: N-(2-acetylphenyl)-2-(1,3-benzodioxol-5-yl)quinoline-4-carboxamide hydrochloride CAS Name: N-(2-acetylphenyl)-2-(1,3-benzodioxol-5-yl)-4-quinolinecarboxamide hydrochloride IUPAC Name: N-(2-acetylphenyl)-2-(1,3-benzodioxol-5-yl)quinoline-4-carboxamide hydrochloride Traditional Name: N-(2-acetylphenyl)-2-(1,3-benzodioxol-5-yl)cinchoninamide hydrochloride Formula: C25H19ClN2O4 MolecularWeight: 446.88236

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5.Cl

Isomeric SMILES

CC(=O)C1=CC=CC=C1NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5.Cl

InChI

InChI=1S/C25H18N2O4.ClH/c1-15(28)17-6-2-4-8-20(17)27-25(29)19-13-22(26-21-9-5-3-7-18(19)21)16-10-11-23-24(12-16)31-14-30-23;/h2-13H,14H2,1H3,(H,27,29);1H