2-(4-chloranylphenoxy)-N-[(3R)-2-oxidanylideneazepan-3-yl]pyridine-3-carboxamide

Systemtic Name: 2-(4-chloranylphenoxy)-N-[(3R)-2-oxidanylideneazepan-3-yl]pyridine-3-carboxamide Openeye Name: 2-(4-chlorophenoxy)-N-[(3R)-2-oxoazepan-3-yl]pyridine-3-carboxamide CAS Name: 2-(4-chlorophenoxy)-N-[(3R)-2-oxo-3-azepanyl]-3-pyridinecarboxamide IUPAC Name: 2-(4-chlorophenoxy)-N-[(3R)-2-oxoazepan-3-yl]pyridine-3-carboxamide Traditional Name: 2-(4-chlorophenoxy)-N-[(3R)-2-ketoazepan-3-yl]nicotinamide Formula: C18H18ClN3O3 MolecularWeight: 359.80682

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)C2=C(N=CC=C2)OC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCNC(=O)[C@@H](C1)NC(=O)C2=C(N=CC=C2)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18ClN3O3/c19-12-6-8-13(9-7-12)25-18-14(4-3-11-21-18)16(23)22-15-5-1-2-10-20-17(15)24/h3-4,6-9,11,15H,1-2,5,10H2,(H,20,24)(H,22,23)/t15-/m1/s1