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

Systemtic Name: 2-(2,4-dimethylphenoxy)-N-[(3S)-2-oxidanylideneazepan-3-yl]pyridine-3-carboxamide Openeye Name: 2-(2,4-dimethylphenoxy)-N-[(3S)-2-oxoazepan-3-yl]pyridine-3-carboxamide CAS Name: 2-(2,4-dimethylphenoxy)-N-[(3S)-2-oxo-3-azepanyl]-3-pyridinecarboxamide IUPAC Name: 2-(2,4-dimethylphenoxy)-N-[(3S)-2-oxoazepan-3-yl]pyridine-3-carboxamide Traditional Name: 2-(2,4-dimethylphenoxy)-N-[(3S)-2-ketoazepan-3-yl]nicotinamide Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O3/c1-13-8-9-17(14(2)12-13)26-20-15(6-5-11-22-20)18(24)23-16-7-3-4-10-21-19(16)25/h5-6,8-9,11-12,16H,3-4,7,10H2,1-2H3,(H,21,25)(H,23,24)/t16-/m0/s1