N-[2-(azepan-1-yl)-5-chloranyl-phenyl]-2-[2-(phenylmethyl)phenoxy]ethanamide

Systemtic Name: N-[2-(azepan-1-yl)-5-chloranyl-phenyl]-2-[2-(phenylmethyl)phenoxy]ethanamide Openeye Name: N-[2-(azepan-1-yl)-5-chloro-phenyl]-2-(2-benzylphenoxy)acetamide CAS Name: N-[2-(1-azepanyl)-5-chlorophenyl]-2-[2-(phenylmethyl)phenoxy]acetamide IUPAC Name: N-[2-(azepan-1-yl)-5-chlorophenyl]-2-(2-benzylphenoxy)acetamide Traditional Name: N-[2-(azepan-1-yl)-5-chloro-phenyl]-2-(2-benzylphenoxy)acetamide Formula: C27H29ClN2O2 MolecularWeight: 448.98436

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)COC3=CC=CC=C3CC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)COC3=CC=CC=C3CC4=CC=CC=C4

InChI

InChI=1S/C27H29ClN2O2/c28-23-14-15-25(30-16-8-1-2-9-17-30)24(19-23)29-27(31)20-32-26-13-7-6-12-22(26)18-21-10-4-3-5-11-21/h3-7,10-15,19H,1-2,8-9,16-18,20H2,(H,29,31)