2-(1,3-benzodioxol-5-yl)-N-[(3,4-dichlorophenyl)methyl]quinoline-4-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-[(3,4-dichlorophenyl)methyl]quinoline-4-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-[(3,4-dichlorophenyl)methyl]quinoline-4-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-[(3,4-dichlorophenyl)methyl]-4-quinolinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-[(3,4-dichlorophenyl)methyl]quinoline-4-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-(3,4-dichlorobenzyl)cinchoninamide Formula: C24H16Cl2N2O3 MolecularWeight: 451.30144

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)NCC5=CC(=C(C=C5)Cl)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)NCC5=CC(=C(C=C5)Cl)Cl

InChI

InChI=1S/C24H16Cl2N2O3/c25-18-7-5-14(9-19(18)26)12-27-24(29)17-11-21(28-20-4-2-1-3-16(17)20)15-6-8-22-23(10-15)31-13-30-22/h1-11H,12-13H2,(H,27,29)