6-chloranyl-3-oxidanylidene-2-[1-[(4-prop-2-enoxyphenyl)methyl]piperidin-4-yl]-1H-isoindole-5-sulfonamide hydrochloride

Systemtic Name: 6-chloranyl-3-oxidanylidene-2-[1-[(4-prop-2-enoxyphenyl)methyl]piperidin-4-yl]-1H-isoindole-5-sulfonamide hydrochloride Openeye Name: 2-[1-[(4-allyloxyphenyl)methyl]-4-piperidyl]-6-chloro-3-oxo-isoindoline-5-sulfonamide hydrochloride CAS Name: 6-chloro-3-oxo-2-[1-[(4-prop-2-enoxyphenyl)methyl]-4-piperidinyl]-1H-isoindole-5-sulfonamide hydrochloride IUPAC Name: 6-chloro-3-oxo-2-[1-[(4-prop-2-enoxyphenyl)methyl]piperidin-4-yl]-1H-isoindole-5-sulfonamide hydrochloride Traditional Name: 2-[1-(4-allyloxybenzyl)-4-piperidyl]-6-chloro-3-keto-isoindoline-5-sulfonamide hydrochloride Formula: C23H27Cl2N3O4S MolecularWeight: 512.44918

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=C(C=C1)CN2CCC(CC2)N3CC4=CC(=C(C=C4C3=O)S(=O)(=O)N)Cl.Cl

Isomeric SMILES

C=CCOC1=CC=C(C=C1)CN2CCC(CC2)N3CC4=CC(=C(C=C4C3=O)S(=O)(=O)N)Cl.Cl

InChI

InChI=1S/C23H26ClN3O4S.ClH/c1-2-11-31-19-5-3-16(4-6-19)14-26-9-7-18(8-10-26)27-15-17-12-21(24)22(32(25,29)30)13-20(17)23(27)28;/h2-6,12-13,18H,1,7-11,14-15H2,(H2,25,29,30);1H