N-[5-azanyl-2-(1,3-benzodioxol-5-ylmethylcarbamoyl)-4-bromanyl-phenyl]pyridine-4-carboxamide

Systemtic Name: N-[5-azanyl-2-(1,3-benzodioxol-5-ylmethylcarbamoyl)-4-bromanyl-phenyl]pyridine-4-carboxamide Openeye Name: N-[5-amino-2-(1,3-benzodioxol-5-ylmethylcarbamoyl)-4-bromo-phenyl]pyridine-4-carboxamide CAS Name: N-[5-amino-2-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]-4-bromophenyl]-4-pyridinecarboxamide IUPAC Name: N-[5-amino-2-(1,3-benzodioxol-5-ylmethylcarbamoyl)-4-bromophenyl]pyridine-4-carboxamide Traditional Name: N-[5-amino-4-bromo-2-(piperonylcarbamoyl)phenyl]isonicotinamide Formula: C21H17BrN4O4 MolecularWeight: 469.28808

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC(=C(C=C3NC(=O)C4=CC=NC=C4)N)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC(=C(C=C3NC(=O)C4=CC=NC=C4)N)Br

InChI

InChI=1S/C21H17BrN4O4/c22-15-8-14(17(9-16(15)23)26-20(27)13-3-5-24-6-4-13)21(28)25-10-12-1-2-18-19(7-12)30-11-29-18/h1-9H,10-11,23H2,(H,25,28)(H,26,27)