N-[3-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]-3-chloranyl-benzenesulfonamide

Systemtic Name: N-[3-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]-3-chloranyl-benzenesulfonamide Openeye Name: N-[3-[3-(1,3-benzoxazol-2-yl)-1-piperidyl]-3-oxo-propyl]-3-chloro-benzenesulfonamide CAS Name: N-[3-[3-(1,3-benzoxazol-2-yl)-1-piperidinyl]-3-oxopropyl]-3-chlorobenzenesulfonamide IUPAC Name: N-[3-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-3-oxopropyl]-3-chlorobenzenesulfonamide Traditional Name: N-[3-[3-(1,3-benzoxazol-2-yl)piperidino]-3-keto-propyl]-3-chloro-benzenesulfonamide Formula: C21H22ClN3O4S MolecularWeight: 447.93508

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCNS(=O)(=O)C2=CC(=CC=C2)Cl)C3=NC4=CC=CC=C4O3

Isomeric SMILES

C1CC(CN(C1)C(=O)CCNS(=O)(=O)C2=CC(=CC=C2)Cl)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C21H22ClN3O4S/c22-16-6-3-7-17(13-16)30(27,28)23-11-10-20(26)25-12-4-5-15(14-25)21-24-18-8-1-2-9-19(18)29-21/h1-3,6-9,13,15,23H,4-5,10-12,14H2