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2-(1,3-benzodioxol-5-yl)-N-(4-butylphenyl)quinoline-4-carboxamide

2-(1,3-benzodioxol-5-yl)-N-(4-butylphenyl)quinoline-4-carboxamide

Systemtic Name:2-(1,3-benzodioxol-5-yl)-N-(4-butylphenyl)quinoline-4-carboxamide
Openeye Name:2-(1,3-benzodioxol-5-yl)-N-(4-butylphenyl)quinoline-4-carboxamide
CAS Name:2-(1,3-benzodioxol-5-yl)-N-(4-butylphenyl)-4-quinolinecarboxamide
IUPAC Name:2-(1,3-benzodioxol-5-yl)-N-(4-butylphenyl)quinoline-4-carboxamide
Traditional Name:2-(1,3-benzodioxol-5-yl)-N-(4-butylphenyl)cinchoninamide
Formula: C27H24N2O3
MolecularWeight: 424.49106
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5


Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5


InChI

InChI=1S/C27H24N2O3/c1-2-3-6-18-9-12-20(13-10-18)28-27(30)22-16-24(29-23-8-5-4-7-21(22)23)19-11-14-25-26(15-19)32-17-31-25/h4-5,7-16H,2-3,6,17H2,1H3,(H,28,30)


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