N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(3-chloranylphenoxy)propanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(3-chloranylphenoxy)propanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(3-chlorophenoxy)propanamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-(3-chlorophenoxy)propanamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(3-chlorophenoxy)propanamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(3-chlorophenoxy)propionamide Formula: C21H25ClN2O4S MolecularWeight: 436.9522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2)OC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2)OC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H25ClN2O4S/c1-16(28-19-10-6-8-17(22)14-19)21(25)23-18-9-7-11-20(15-18)29(26,27)24-12-4-2-3-5-13-24/h6-11,14-16H,2-5,12-13H2,1H3,(H,23,25)