5-[(3-chloranyl-2-oxidanyl-propyl)-ethyl-amino]-2-methyl-isoindole-1,3-dione

Systemtic Name: 5-[(3-chloranyl-2-oxidanyl-propyl)-ethyl-amino]-2-methyl-isoindole-1,3-dione Openeye Name: 5-[(3-chloro-2-hydroxy-propyl)-ethyl-amino]-2-methyl-isoindoline-1,3-dione CAS Name: 5-[(3-chloro-2-hydroxypropyl)-ethylamino]-2-methylisoindole-1,3-dione IUPAC Name: 5-[(3-chloro-2-hydroxypropyl)-ethylamino]-2-methylisoindole-1,3-dione Traditional Name: 5-[(3-chloro-2-hydroxy-propyl)-ethyl-amino]-2-methyl-isoindoline-1,3-quinone Formula: C14H17ClN2O3 MolecularWeight: 296.74938

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(CCl)O)C1=CC2=C(C=C1)C(=O)N(C2=O)C

Isomeric SMILES

CCN(CC(CCl)O)C1=CC2=C(C=C1)C(=O)N(C2=O)C

InChI

InChI=1S/C14H17ClN2O3/c1-3-17(8-10(18)7-15)9-4-5-11-12(6-9)14(20)16(2)13(11)19/h4-6,10,18H,3,7-8H2,1-2H3