N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)-3-methyl-4-quinolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide Traditional Name: 2-(4-methoxyphenyl)-3-methyl-N-piperonyl-cinchoninamide Formula: C26H22N2O4 MolecularWeight: 426.46388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N=C1C3=CC=C(C=C3)OC)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(C2=CC=CC=C2N=C1C3=CC=C(C=C3)OC)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H22N2O4/c1-16-24(26(29)27-14-17-7-12-22-23(13-17)32-15-31-22)20-5-3-4-6-21(20)28-25(16)18-8-10-19(30-2)11-9-18/h3-13H,14-15H2,1-2H3,(H,27,29)