N-[(E)-[3-(1,3-benzodioxol-5-yl)-2-methyl-propylidene]amino]-2-propyl-quinoline-4-carboxamide

Systemtic Name: N-[(E)-[3-(1,3-benzodioxol-5-yl)-2-methyl-propylidene]amino]-2-propyl-quinoline-4-carboxamide Openeye Name: N-[(E)-[3-(1,3-benzodioxol-5-yl)-2-methyl-propylidene]amino]-2-propyl-quinoline-4-carboxamide CAS Name: N-[(E)-[3-(1,3-benzodioxol-5-yl)-2-methylpropylidene]amino]-2-propyl-4-quinolinecarboxamide IUPAC Name: N-[(E)-[3-(1,3-benzodioxol-5-yl)-2-methylpropylidene]amino]-2-propylquinoline-4-carboxamide Traditional Name: N-[(E)-[3-(1,3-benzodioxol-5-yl)-2-methyl-propylidene]amino]-2-propyl-cinchoninamide Formula: C24H25N3O3 MolecularWeight: 403.4736

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2C(=C1)C(=O)NN=CC(C)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCC1=NC2=CC=CC=C2C(=C1)C(=O)N/N=C/C(C)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H25N3O3/c1-3-6-18-13-20(19-7-4-5-8-21(19)26-18)24(28)27-25-14-16(2)11-17-9-10-22-23(12-17)30-15-29-22/h4-5,7-10,12-14,16H,3,6,11,15H2,1-2H3,(H,27,28)/b25-14+