6-[(6-chloranyl-1,3-benzodioxol-5-yl)amino]-N-phenethyl-pyridine-3-carboxamide

Systemtic Name: 6-[(6-chloranyl-1,3-benzodioxol-5-yl)amino]-N-phenethyl-pyridine-3-carboxamide Openeye Name: 6-[(6-chloro-1,3-benzodioxol-5-yl)amino]-N-phenethyl-pyridine-3-carboxamide CAS Name: 6-[(6-chloro-1,3-benzodioxol-5-yl)amino]-N-phenethyl-3-pyridinecarboxamide IUPAC Name: 6-[(6-chloro-1,3-benzodioxol-5-yl)amino]-N-phenethylpyridine-3-carboxamide Traditional Name: 6-[(6-chloro-1,3-benzodioxol-5-yl)amino]-N-phenethyl-nicotinamide Formula: C21H18ClN3O3 MolecularWeight: 395.83892

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)NC3=NC=C(C=C3)C(=O)NCCC4=CC=CC=C4)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)NC3=NC=C(C=C3)C(=O)NCCC4=CC=CC=C4)Cl

InChI

InChI=1S/C21H18ClN3O3/c22-16-10-18-19(28-13-27-18)11-17(16)25-20-7-6-15(12-24-20)21(26)23-9-8-14-4-2-1-3-5-14/h1-7,10-12H,8-9,13H2,(H,23,26)(H,24,25)