N-(1,3-benzodioxol-5-ylmethyl)-7-chloranyl-8-methyl-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-7-chloranyl-8-methyl-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-7-chloro-8-methyl-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-7-chloro-8-methyl-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-7-chloro-8-methyl-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: 7-chloro-8-methyl-N-piperonyl-2-(2-pyridyl)cinchoninamide Formula: C24H18ClN3O3 MolecularWeight: 431.87102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(C=C2C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=CC=N5)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(C=C2C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=CC=N5)Cl

InChI

InChI=1S/C24H18ClN3O3/c1-14-18(25)7-6-16-17(11-20(28-23(14)16)19-4-2-3-9-26-19)24(29)27-12-15-5-8-21-22(10-15)31-13-30-21/h2-11H,12-13H2,1H3,(H,27,29)