N-[1-(1,3-benzodioxol-5-yl)ethyl]-6-methyl-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-6-methyl-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-6-methyl-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-6-methyl-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-6-methyl-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-6-methyl-2-(4-pyridyl)cinchoninamide Formula: C25H21N3O3 MolecularWeight: 411.45254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC(C)C3=CC4=C(C=C3)OCO4)C5=CC=NC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC(C)C3=CC4=C(C=C3)OCO4)C5=CC=NC=C5

InChI

InChI=1S/C25H21N3O3/c1-15-3-5-21-19(11-15)20(13-22(28-21)17-7-9-26-10-8-17)25(29)27-16(2)18-4-6-23-24(12-18)31-14-30-23/h3-13,16H,14H2,1-2H3,(H,27,29)