2-[2-(azepan-1-ylmethyl)-5-methoxy-4-oxidanylidene-pyridin-1-yl]-N-[(4-methylphenyl)methyl]ethanamide

Systemtic Name: 2-[2-(azepan-1-ylmethyl)-5-methoxy-4-oxidanylidene-pyridin-1-yl]-N-[(4-methylphenyl)methyl]ethanamide Openeye Name: 2-[2-(azepan-1-ylmethyl)-5-methoxy-4-oxo-1-pyridyl]-N-(p-tolylmethyl)acetamide CAS Name: 2-[2-(1-azepanylmethyl)-5-methoxy-4-oxo-1-pyridinyl]-N-[(4-methylphenyl)methyl]acetamide IUPAC Name: 2-[2-(azepan-1-ylmethyl)-5-methoxy-4-oxopyridin-1-yl]-N-[(4-methylphenyl)methyl]acetamide Traditional Name: 2-[2-(azepan-1-ylmethyl)-4-keto-5-methoxy-1-pyridyl]-N-(4-methylbenzyl)acetamide Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)CN2C=C(C(=O)C=C2CN3CCCCCC3)OC

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)CN2C=C(C(=O)C=C2CN3CCCCCC3)OC

InChI

InChI=1S/C23H31N3O3/c1-18-7-9-19(10-8-18)14-24-23(28)17-26-16-22(29-2)21(27)13-20(26)15-25-11-5-3-4-6-12-25/h7-10,13,16H,3-6,11-12,14-15,17H2,1-2H3,(H,24,28)