methyl 2-[4-(3-methylbutoxycarbonyl)phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: methyl 2-[4-(3-methylbutoxycarbonyl)phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: methyl 2-(4-isopentyloxycarbonylphenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-[4-[3-methylbutoxy(oxo)methyl]phenyl]-1,3-dioxo-5-isoindolecarboxylic acid methyl ester IUPAC Name: methyl 2-[4-(3-methylbutoxycarbonyl)phenyl]-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(4-isoamoxycarbonylphenyl)-1,3-diketo-isoindoline-5-carboxylic acid methyl ester Formula: C22H21NO6 MolecularWeight: 395.40524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC

Isomeric SMILES

CC(C)CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H21NO6/c1-13(2)10-11-29-22(27)14-4-7-16(8-5-14)23-19(24)17-9-6-15(21(26)28-3)12-18(17)20(23)25/h4-9,12-13H,10-11H2,1-3H3