5-chloranyl-3-[2-(4-hydroxyiminopiperidin-1-yl)-2-oxidanylidene-ethyl]-2-(4-methoxyphenyl)-3H-isoindol-1-one

Systemtic Name: 5-chloranyl-3-[2-(4-hydroxyiminopiperidin-1-yl)-2-oxidanylidene-ethyl]-2-(4-methoxyphenyl)-3H-isoindol-1-one Openeye Name: 5-chloro-3-[2-(4-hydroxyimino-1-piperidyl)-2-oxo-ethyl]-2-(4-methoxyphenyl)isoindolin-1-one CAS Name: 5-chloro-3-[2-(4-hydroxyimino-1-piperidinyl)-2-oxoethyl]-2-(4-methoxyphenyl)-3H-isoindol-1-one IUPAC Name: 5-chloro-3-[2-(4-hydroxyiminopiperidin-1-yl)-2-oxoethyl]-2-(4-methoxyphenyl)-3H-isoindol-1-one Traditional Name: 5-chloro-3-[2-(4-hydroximinopiperidino)-2-keto-ethyl]-2-(4-methoxyphenyl)isoindolin-1-one Formula: C22H22ClN3O4 MolecularWeight: 427.88078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(C3=C(C2=O)C=CC(=C3)Cl)CC(=O)N4CCC(=NO)CC4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(C3=C(C2=O)C=CC(=C3)Cl)CC(=O)N4CCC(=NO)CC4

InChI

InChI=1S/C22H22ClN3O4/c1-30-17-5-3-16(4-6-17)26-20(19-12-14(23)2-7-18(19)22(26)28)13-21(27)25-10-8-15(24-29)9-11-25/h2-7,12,20,29H,8-11,13H2,1H3