[7-chloranyl-2-(pyridin-4-ylamino)-1,3-dihydroisoindol-4-yl] N,N-dimethylcarbamate hydrochloride

Systemtic Name: [7-chloranyl-2-(pyridin-4-ylamino)-1,3-dihydroisoindol-4-yl] N,N-dimethylcarbamate hydrochloride Openeye Name: [7-chloro-2-(4-pyridylamino)isoindolin-4-yl] N,N-dimethylcarbamate hydrochloride CAS Name: N,N-dimethylcarbamic acid [7-chloro-2-(pyridin-4-ylamino)-1,3-dihydroisoindol-4-yl] ester hydrochloride IUPAC Name: [7-chloro-2-(pyridin-4-ylamino)-1,3-dihydroisoindol-4-yl] N,N-dimethylcarbamate hydrochloride Traditional Name: N,N-dimethylcarbamic acid [7-chloro-2-(4-pyridylamino)isoindolin-4-yl] ester hydrochloride Formula: C16H18Cl2N4O2 MolecularWeight: 369.24572

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)OC1=C2CN(CC2=C(C=C1)Cl)NC3=CC=NC=C3.Cl

Isomeric SMILES

CN(C)C(=O)OC1=C2CN(CC2=C(C=C1)Cl)NC3=CC=NC=C3.Cl

InChI

InChI=1S/C16H17ClN4O2.ClH/c1-20(2)16(22)23-15-4-3-14(17)12-9-21(10-13(12)15)19-11-5-7-18-8-6-11;/h3-8H,9-10H2,1-2H3,(H,18,19);1H