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

Systemtic Name: N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-3-(3,4-dimethoxyphenyl)propanamide Openeye Name: N-[[6-(azepan-1-yl)-3-pyridyl]methyl]-3-(3,4-dimethoxyphenyl)propanamide CAS Name: N-[[6-(1-azepanyl)-3-pyridinyl]methyl]-3-(3,4-dimethoxyphenyl)propanamide IUPAC Name: N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-3-(3,4-dimethoxyphenyl)propanamide Traditional Name: N-[[6-(azepan-1-yl)-3-pyridyl]methyl]-3-(3,4-dimethoxyphenyl)propionamide Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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