8-chloranyl-3-oxidanyl-5-(2-piperidin-1-ylethyl)-2,3-dihydro-1,5-benzothiazepin-4-one hydrochloride

Systemtic Name: 8-chloranyl-3-oxidanyl-5-(2-piperidin-1-ylethyl)-2,3-dihydro-1,5-benzothiazepin-4-one hydrochloride Openeye Name: 8-chloro-3-hydroxy-5-[2-(1-piperidyl)ethyl]-2,3-dihydro-1,5-benzothiazepin-4-one hydrochloride CAS Name: 8-chloro-3-hydroxy-5-[2-(1-piperidinyl)ethyl]-2,3-dihydro-1,5-benzothiazepin-4-one hydrochloride IUPAC Name: 8-chloro-3-hydroxy-5-(2-piperidin-1-ylethyl)-2,3-dihydro-1,5-benzothiazepin-4-one hydrochloride Traditional Name: 8-chloro-3-hydroxy-5-(2-piperidinoethyl)-2,3-dihydro-1,5-benzothiazepin-4-one hydrochloride Formula: C16H22Cl2N2O2S MolecularWeight: 377.32908

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCN2C3=C(C=C(C=C3)Cl)SCC(C2=O)O.Cl

Isomeric SMILES

C1CCN(CC1)CCN2C3=C(C=C(C=C3)Cl)SCC(C2=O)O.Cl

InChI

InChI=1S/C16H21ClN2O2S.ClH/c17-12-4-5-13-15(10-12)22-11-14(20)16(21)19(13)9-8-18-6-2-1-3-7-18;/h4-5,10,14,20H,1-3,6-9,11H2;1H