(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl 2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl 2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl 2-(3-methoxypropyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(3-methoxypropyl)-1,3-dioxo-5-isoindolecarboxylic acid (5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (5-chloro-3-methyl-1-phenylpyrazol-4-yl)methyl 2-(3-methoxypropyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(3-methoxypropyl)isoindoline-5-carboxylic acid (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl ester Formula: C24H22ClN3O5 MolecularWeight: 467.90158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCCOC)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCCOC)Cl)C4=CC=CC=C4

InChI

InChI=1S/C24H22ClN3O5/c1-15-20(21(25)28(26-15)17-7-4-3-5-8-17)14-33-24(31)16-9-10-18-19(13-16)23(30)27(22(18)29)11-6-12-32-2/h3-5,7-10,13H,6,11-12,14H2,1-2H3