N-[6-(azepan-1-yl)pyridin-3-yl]-4-chloranyl-3-(4-methoxyphenyl)benzamide

Systemtic Name: N-[6-(azepan-1-yl)pyridin-3-yl]-4-chloranyl-3-(4-methoxyphenyl)benzamide Openeye Name: N-[6-(azepan-1-yl)-3-pyridyl]-4-chloro-3-(4-methoxyphenyl)benzamide CAS Name: N-[6-(1-azepanyl)-3-pyridinyl]-4-chloro-3-(4-methoxyphenyl)benzamide IUPAC Name: N-[6-(azepan-1-yl)pyridin-3-yl]-4-chloro-3-(4-methoxyphenyl)benzamide Traditional Name: N-[6-(azepan-1-yl)-3-pyridyl]-4-chloro-3-(4-methoxyphenyl)benzamide Formula: C25H26ClN3O2 MolecularWeight: 435.94584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C=CC(=C2)C(=O)NC3=CN=C(C=C3)N4CCCCCC4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C=CC(=C2)C(=O)NC3=CN=C(C=C3)N4CCCCCC4)Cl

InChI

InChI=1S/C25H26ClN3O2/c1-31-21-10-6-18(7-11-21)22-16-19(8-12-23(22)26)25(30)28-20-9-13-24(27-17-20)29-14-4-2-3-5-15-29/h6-13,16-17H,2-5,14-15H2,1H3,(H,28,30)