4-chloranyl-N-[(3R)-2-oxidanylideneazepan-3-yl]-N-(8-phenyloctyl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[(3R)-2-oxidanylideneazepan-3-yl]-N-(8-phenyloctyl)benzenesulfonamide Openeye Name: 4-chloro-N-[(3R)-2-oxoazepan-3-yl]-N-(8-phenyloctyl)benzenesulfonamide CAS Name: 4-chloro-N-[(3R)-2-oxo-3-azepanyl]-N-(8-phenyloctyl)benzenesulfonamide IUPAC Name: 4-chloro-N-[(3R)-2-oxoazepan-3-yl]-N-(8-phenyloctyl)benzenesulfonamide Traditional Name: 4-chloro-N-[(3R)-2-ketoazepan-3-yl]-N-(8-phenyloctyl)benzenesulfonamide Formula: C26H35ClN2O3S MolecularWeight: 491.0857

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(CCCCCCCCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCNC(=O)[C@@H](C1)N(CCCCCCCCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H35ClN2O3S/c27-23-16-18-24(19-17-23)33(31,32)29(25-15-9-10-20-28-26(25)30)21-11-4-2-1-3-6-12-22-13-7-5-8-14-22/h5,7-8,13-14,16-19,25H,1-4,6,9-12,15,20-21H2,(H,28,30)/t25-/m1/s1