3-azanylidene-6-ethoxy-2-[2-oxidanylidene-2-(3,4,5-trimethoxyphenyl)ethyl]-1H-isoindole-5-carboxylic acid

Systemtic Name: 3-azanylidene-6-ethoxy-2-[2-oxidanylidene-2-(3,4,5-trimethoxyphenyl)ethyl]-1H-isoindole-5-carboxylic acid Openeye Name: 6-ethoxy-3-imino-2-[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]isoindoline-5-carboxylic acid CAS Name: 6-ethoxy-3-imino-2-[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]-1H-isoindole-5-carboxylic acid IUPAC Name: 6-ethoxy-3-imino-2-[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]-1H-isoindole-5-carboxylic acid Traditional Name: 6-ethoxy-3-imino-2-[2-keto-2-(3,4,5-trimethoxyphenyl)ethyl]isoindoline-5-carboxylic acid Formula: C22H24N2O7 MolecularWeight: 428.43516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CN(C2=N)CC(=O)C3=CC(=C(C(=C3)OC)OC)OC)C(=O)O

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CN(C2=N)CC(=O)C3=CC(=C(C(=C3)OC)OC)OC)C(=O)O

InChI

InChI=1S/C22H24N2O7/c1-5-31-17-8-13-10-24(21(23)14(13)9-15(17)22(26)27)11-16(25)12-6-18(28-2)20(30-4)19(7-12)29-3/h6-9,23H,5,10-11H2,1-4H3,(H,26,27)