2-(4-methylphenoxy)-N-[(3S)-2-oxidanylideneazepan-3-yl]pyridine-3-carboxamide

Systemtic Name: 2-(4-methylphenoxy)-N-[(3S)-2-oxidanylideneazepan-3-yl]pyridine-3-carboxamide Openeye Name: 2-(4-methylphenoxy)-N-[(3S)-2-oxoazepan-3-yl]pyridine-3-carboxamide CAS Name: 2-(4-methylphenoxy)-N-[(3S)-2-oxo-3-azepanyl]-3-pyridinecarboxamide IUPAC Name: 2-(4-methylphenoxy)-N-[(3S)-2-oxoazepan-3-yl]pyridine-3-carboxamide Traditional Name: N-[(3S)-2-ketoazepan-3-yl]-2-(4-methylphenoxy)nicotinamide Formula: C19H21N3O3 MolecularWeight: 339.38834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)NC3CCCCNC3=O

Isomeric SMILES

CC1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)N[C@H]3CCCCNC3=O

InChI

InChI=1S/C19H21N3O3/c1-13-7-9-14(10-8-13)25-19-15(5-4-12-21-19)17(23)22-16-6-2-3-11-20-18(16)24/h4-5,7-10,12,16H,2-3,6,11H2,1H3,(H,20,24)(H,22,23)/t16-/m0/s1