2-[1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-6,7-dimethoxy-3H-isoindol-1-one

Systemtic Name: 2-[1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-6,7-dimethoxy-3H-isoindol-1-one Openeye Name: 2-[1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-6,7-dimethoxy-isoindolin-1-one CAS Name: 2-[1-[(4-chlorophenyl)methyl]-3-pyrazolyl]-6,7-dimethoxy-3H-isoindol-1-one IUPAC Name: 2-[1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-6,7-dimethoxy-3H-isoindol-1-one Traditional Name: 2-[1-(4-chlorobenzyl)pyrazol-3-yl]-6,7-dimethoxy-isoindolin-1-one Formula: C20H18ClN3O3 MolecularWeight: 383.82822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(CN(C2=O)C3=NN(C=C3)CC4=CC=C(C=C4)Cl)C=C1)OC

Isomeric SMILES

COC1=C(C2=C(CN(C2=O)C3=NN(C=C3)CC4=CC=C(C=C4)Cl)C=C1)OC

InChI

InChI=1S/C20H18ClN3O3/c1-26-16-8-5-14-12-24(20(25)18(14)19(16)27-2)17-9-10-23(22-17)11-13-3-6-15(21)7-4-13/h3-10H,11-12H2,1-2H3