4-[2-[(4-chlorophenyl)methoxy]ethyl]-1-(phenylsulfonyl)-1,4-diazepan-5-one

Systemtic Name: 4-[2-[(4-chlorophenyl)methoxy]ethyl]-1-(phenylsulfonyl)-1,4-diazepan-5-one Openeye Name: 1-(benzenesulfonyl)-4-[2-[(4-chlorophenyl)methoxy]ethyl]-1,4-diazepan-5-one CAS Name: 1-(benzenesulfonyl)-4-[2-[(4-chlorophenyl)methoxy]ethyl]-1,4-diazepan-5-one IUPAC Name: 1-(benzenesulfonyl)-4-[2-[(4-chlorophenyl)methoxy]ethyl]-1,4-diazepan-5-one Traditional Name: 1-besyl-4-[2-(4-chlorobenzyl)oxyethyl]-1,4-diazepan-5-one Formula: C20H23ClN2O4S MolecularWeight: 422.92562

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1=O)CCOCC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1=O)CCOCC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H23ClN2O4S/c21-18-8-6-17(7-9-18)16-27-15-14-22-12-13-23(11-10-20(22)24)28(25,26)19-4-2-1-3-5-19/h1-9H,10-16H2