N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-2-(4-methylphenyl)quinoline-6-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-2-(4-methylphenyl)quinoline-6-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-2-(p-tolyl)quinoline-6-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-2-(4-methylphenyl)-6-quinolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-2-(4-methylphenyl)quinoline-6-carboxamide Traditional Name: 4-methoxy-N-piperonyl-2-(p-tolyl)quinoline-6-carboxamide Formula: C26H22N2O4 MolecularWeight: 426.46388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)C(=O)NCC4=CC5=C(C=C4)OCO5)C(=C2)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)C(=O)NCC4=CC5=C(C=C4)OCO5)C(=C2)OC

InChI

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