3-azanyl-1-(5-chloranyl-1,3-dihydroisoindol-2-yl)-3-methyl-butan-1-one

Systemtic Name: 3-azanyl-1-(5-chloranyl-1,3-dihydroisoindol-2-yl)-3-methyl-butan-1-one Openeye Name: 3-amino-1-(5-chloroisoindolin-2-yl)-3-methyl-butan-1-one CAS Name: 3-amino-1-(5-chloro-1,3-dihydroisoindol-2-yl)-3-methyl-1-butanone IUPAC Name: 3-amino-1-(5-chloro-1,3-dihydroisoindol-2-yl)-3-methylbutan-1-one Traditional Name: 3-amino-1-(5-chloroisoindolin-2-yl)-3-methyl-butan-1-one Formula: C13H17ClN2O MolecularWeight: 252.73988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)N1CC2=C(C1)C=C(C=C2)Cl)N

Isomeric SMILES

CC(C)(CC(=O)N1CC2=C(C1)C=C(C=C2)Cl)N

InChI

InChI=1S/C13H17ClN2O/c1-13(2,15)6-12(17)16-7-9-3-4-11(14)5-10(9)8-16/h3-5H,6-8,15H2,1-2H3