6-chloranyl-2-[1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl]-3-oxidanylidene-1H-isoindole-5-sulfonamide

Systemtic Name: 6-chloranyl-2-[1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl]-3-oxidanylidene-1H-isoindole-5-sulfonamide Openeye Name: 6-chloro-2-[1-[2-(4-methoxyphenyl)ethyl]-4-piperidyl]-3-oxo-isoindoline-5-sulfonamide CAS Name: 6-chloro-2-[1-[2-(4-methoxyphenyl)ethyl]-4-piperidinyl]-3-oxo-1H-isoindole-5-sulfonamide IUPAC Name: 6-chloro-2-[1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl]-3-oxo-1H-isoindole-5-sulfonamide Traditional Name: 6-chloro-3-keto-2-[1-[2-(4-methoxyphenyl)ethyl]-4-piperidyl]isoindoline-5-sulfonamide Formula: C22H26ClN3O4S MolecularWeight: 463.97754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCN2CCC(CC2)N3CC4=CC(=C(C=C4C3=O)S(=O)(=O)N)Cl

Isomeric SMILES

COC1=CC=C(C=C1)CCN2CCC(CC2)N3CC4=CC(=C(C=C4C3=O)S(=O)(=O)N)Cl

InChI

InChI=1S/C22H26ClN3O4S/c1-30-18-4-2-15(3-5-18)6-9-25-10-7-17(8-11-25)26-14-16-12-20(23)21(31(24,28)29)13-19(16)22(26)27/h2-5,12-13,17H,6-11,14H2,1H3,(H2,24,28,29)