2-[4-(6-bromanyl-3-methyl-2-oxidanylidene-1,3-benzothiazol-4-yl)-2-(4-methoxyphenyl)piperidin-1-yl]ethanal hydrochloride

Systemtic Name: 2-[4-(6-bromanyl-3-methyl-2-oxidanylidene-1,3-benzothiazol-4-yl)-2-(4-methoxyphenyl)piperidin-1-yl]ethanal hydrochloride Openeye Name: 2-[4-(6-bromo-3-methyl-2-oxo-1,3-benzothiazol-4-yl)-2-(4-methoxyphenyl)-1-piperidyl]acetaldehyde hydrochloride CAS Name: 2-[4-(6-bromo-3-methyl-2-oxo-1,3-benzothiazol-4-yl)-2-(4-methoxyphenyl)-1-piperidinyl]acetaldehyde hydrochloride IUPAC Name: 2-[4-(6-bromo-3-methyl-2-oxo-1,3-benzothiazol-4-yl)-2-(4-methoxyphenyl)piperidin-1-yl]acetaldehyde hydrochloride Traditional Name: 2-[4-(6-bromo-2-keto-3-methyl-1,3-benzothiazol-4-yl)-2-(4-methoxyphenyl)piperidino]acetaldehyde hydrochloride Formula: C22H24BrClN2O3S MolecularWeight: 511.85956

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2C3CCN(C(C3)C4=CC=C(C=C4)OC)CC=O)Br)SC1=O.Cl

Isomeric SMILES

CN1C2=C(C=C(C=C2C3CCN(C(C3)C4=CC=C(C=C4)OC)CC=O)Br)SC1=O.Cl

InChI

InChI=1S/C22H23BrN2O3S.ClH/c1-24-21-18(12-16(23)13-20(21)29-22(24)27)15-7-8-25(9-10-26)19(11-15)14-3-5-17(28-2)6-4-14;/h3-6,10,12-13,15,19H,7-9,11H2,1-2H3;1H