ethyl 4-[7a-methyl-1,3-bis(oxidanylidene)-4,7-dihydro-3aH-isoindol-2-yl]benzoate

Systemtic Name: ethyl 4-[7a-methyl-1,3-bis(oxidanylidene)-4,7-dihydro-3aH-isoindol-2-yl]benzoate Openeye Name: ethyl 4-(7a-methyl-1,3-dioxo-4,7-dihydro-3aH-isoindol-2-yl)benzoate CAS Name: 4-(7a-methyl-1,3-dioxo-4,7-dihydro-3aH-isoindol-2-yl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(7a-methyl-1,3-dioxo-4,7-dihydro-3aH-isoindol-2-yl)benzoate Traditional Name: 4-(1,3-diketo-7a-methyl-4,7-dihydro-3aH-isoindol-2-yl)benzoic acid ethyl ester Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3CC=CCC3(C2=O)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3CC=CCC3(C2=O)C

InChI

InChI=1S/C18H19NO4/c1-3-23-16(21)12-7-9-13(10-8-12)19-15(20)14-6-4-5-11-18(14,2)17(19)22/h4-5,7-10,14H,3,6,11H2,1-2H3