6-(3,4-diethoxyphenyl)-3,4-dihydro-2H-pyrimido[1,2-b]isoindol-6-ol hydrochloride

Systemtic Name: 6-(3,4-diethoxyphenyl)-3,4-dihydro-2H-pyrimido[1,2-b]isoindol-6-ol hydrochloride Openeye Name: 6-(3,4-diethoxyphenyl)-3,4-dihydro-2H-pyrimido[1,2-b]isoindol-6-ol hydrochloride CAS Name: 6-(3,4-diethoxyphenyl)-3,4-dihydro-2H-pyrimido[1,2-b]isoindol-6-ol hydrochloride IUPAC Name: 6-(3,4-diethoxyphenyl)-3,4-dihydro-2H-pyrimido[1,2-b]isoindol-6-ol hydrochloride Traditional Name: 6-(3,4-diethoxyphenyl)-3,4-dihydro-2H-pyrimid[1,2-b]isoindol-6-ol hydrochloride Formula: C21H25ClN2O3 MolecularWeight: 388.8878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2(C3=CC=CC=C3C4=NCCCN42)O)OCC.Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2(C3=CC=CC=C3C4=NCCCN42)O)OCC.Cl

InChI

InChI=1S/C21H24N2O3.ClH/c1-3-25-18-11-10-15(14-19(18)26-4-2)21(24)17-9-6-5-8-16(17)20-22-12-7-13-23(20)21;/h5-6,8-11,14,24H,3-4,7,12-13H2,1-2H3;1H