N-[2-(azepan-1-yl)phenyl]-3,4,5-tris(chloranyl)pyridine-2-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)phenyl]-3,4,5-tris(chloranyl)pyridine-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)phenyl]-3,4,5-trichloro-pyridine-2-carboxamide CAS Name: N-[2-(1-azepanyl)phenyl]-3,4,5-trichloro-2-pyridinecarboxamide IUPAC Name: N-[2-(azepan-1-yl)phenyl]-3,4,5-trichloropyridine-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)phenyl]-3,4,5-trichloro-picolinamide Formula: C18H18Cl3N3O MolecularWeight: 398.71402

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=CC=C2NC(=O)C3=NC=C(C(=C3Cl)Cl)Cl

Isomeric SMILES

C1CCCN(CC1)C2=CC=CC=C2NC(=O)C3=NC=C(C(=C3Cl)Cl)Cl

InChI

InChI=1S/C18H18Cl3N3O/c19-12-11-22-17(16(21)15(12)20)18(25)23-13-7-3-4-8-14(13)24-9-5-1-2-6-10-24/h3-4,7-8,11H,1-2,5-6,9-10H2,(H,23,25)