N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-(3-bromophenyl)-2-methyl-pyridine-3-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-(3-bromophenyl)-2-methyl-pyridine-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-(3-bromophenyl)-2-methyl-pyridine-3-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-(3-bromophenyl)-2-methyl-3-pyridinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-(3-bromophenyl)-2-methylpyridine-3-carboxamide Traditional Name: 6-(3-bromophenyl)-N-homopiperonyl-2-methyl-nicotinamide Formula: C22H19BrN2O3 MolecularWeight: 439.30186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C2=CC(=CC=C2)Br)C(=O)NCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C=CC(=N1)C2=CC(=CC=C2)Br)C(=O)NCCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H19BrN2O3/c1-14-18(6-7-19(25-14)16-3-2-4-17(23)12-16)22(26)24-10-9-15-5-8-20-21(11-15)28-13-27-20/h2-8,11-12H,9-10,13H2,1H3,(H,24,26)