1-[(4-methylphenyl)methyl]-5-[methyl(2-pyridin-2-ylethyl)amino]azepan-2-one

Systemtic Name: 1-[(4-methylphenyl)methyl]-5-[methyl(2-pyridin-2-ylethyl)amino]azepan-2-one Openeye Name: 5-[methyl-[2-(2-pyridyl)ethyl]amino]-1-(p-tolylmethyl)azepan-2-one CAS Name: 1-[(4-methylphenyl)methyl]-5-[methyl-[2-(2-pyridinyl)ethyl]amino]-2-azepanone IUPAC Name: 1-[(4-methylphenyl)methyl]-5-[methyl(2-pyridin-2-ylethyl)amino]azepan-2-one Traditional Name: 1-(4-methylbenzyl)-5-[methyl-[2-(2-pyridyl)ethyl]amino]azepan-2-one Formula: C22H29N3O MolecularWeight: 351.48516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCC(CCC2=O)N(C)CCC3=CC=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCC(CCC2=O)N(C)CCC3=CC=CC=N3

InChI

InChI=1S/C22H29N3O/c1-18-6-8-19(9-7-18)17-25-16-13-21(10-11-22(25)26)24(2)15-12-20-5-3-4-14-23-20/h3-9,14,21H,10-13,15-17H2,1-2H3