N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-3-(4-methoxyphenyl)propanamide

Systemtic Name: N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-3-(4-methoxyphenyl)propanamide Openeye Name: N-[[6-(azepan-1-yl)-3-pyridyl]methyl]-3-(4-methoxyphenyl)propanamide CAS Name: N-[[6-(1-azepanyl)-3-pyridinyl]methyl]-3-(4-methoxyphenyl)propanamide IUPAC Name: N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-3-(4-methoxyphenyl)propanamide Traditional Name: N-[[6-(azepan-1-yl)-3-pyridyl]methyl]-3-(4-methoxyphenyl)propionamide Formula: C22H29N3O2 MolecularWeight: 367.48456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=O)NCC2=CN=C(C=C2)N3CCCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=O)NCC2=CN=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C22H29N3O2/c1-27-20-10-6-18(7-11-20)9-13-22(26)24-17-19-8-12-21(23-16-19)25-14-4-2-3-5-15-25/h6-8,10-12,16H,2-5,9,13-15,17H2,1H3,(H,24,26)