N-[4-(azepan-1-yl)phenyl]-4-(4-chloranyl-3-methyl-phenoxy)butanamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-4-(4-chloranyl-3-methyl-phenoxy)butanamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-4-(4-chloro-3-methyl-phenoxy)butanamide CAS Name: N-[4-(1-azepanyl)phenyl]-4-(4-chloro-3-methylphenoxy)butanamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-4-(4-chloro-3-methylphenoxy)butanamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-4-(4-chloro-3-methyl-phenoxy)butyramide Formula: C23H29ClN2O2 MolecularWeight: 400.94156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCC(=O)NC2=CC=C(C=C2)N3CCCCCC3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCC(=O)NC2=CC=C(C=C2)N3CCCCCC3)Cl

InChI

InChI=1S/C23H29ClN2O2/c1-18-17-21(12-13-22(18)24)28-16-6-7-23(27)25-19-8-10-20(11-9-19)26-14-4-2-3-5-15-26/h8-13,17H,2-7,14-16H2,1H3,(H,25,27)