[2-(pyridin-4-ylamino)-1,3-dihydroisoindol-4-yl] N-methyl-N-(phenylmethyl)carbamate hydrochloride

Systemtic Name: [2-(pyridin-4-ylamino)-1,3-dihydroisoindol-4-yl] N-methyl-N-(phenylmethyl)carbamate hydrochloride Openeye Name: [2-(4-pyridylamino)isoindolin-4-yl] N-benzyl-N-methyl-carbamate hydrochloride CAS Name: N-methyl-N-(phenylmethyl)carbamic acid [2-(pyridin-4-ylamino)-1,3-dihydroisoindol-4-yl] ester hydrochloride IUPAC Name: [2-(pyridin-4-ylamino)-1,3-dihydroisoindol-4-yl] N-benzyl-N-methylcarbamate hydrochloride Traditional Name: N-benzyl-N-methyl-carbamic acid [2-(4-pyridylamino)isoindolin-4-yl] ester hydrochloride Formula: C22H23ClN4O2 MolecularWeight: 410.89662

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)OC2=CC=CC3=C2CN(C3)NC4=CC=NC=C4.Cl

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)OC2=CC=CC3=C2CN(C3)NC4=CC=NC=C4.Cl

InChI

InChI=1S/C22H22N4O2.ClH/c1-25(14-17-6-3-2-4-7-17)22(27)28-21-9-5-8-18-15-26(16-20(18)21)24-19-10-12-23-13-11-19;/h2-13H,14-16H2,1H3,(H,23,24);1H