3-azanylidene-6-ethoxy-2-[2-oxidanylidene-2-(1,3,3-trimethyl-2H-indol-5-yl)ethyl]-1H-isoindole-5-carboxylic acid

Systemtic Name: 3-azanylidene-6-ethoxy-2-[2-oxidanylidene-2-(1,3,3-trimethyl-2H-indol-5-yl)ethyl]-1H-isoindole-5-carboxylic acid Openeye Name: 6-ethoxy-3-imino-2-[2-oxo-2-(1,3,3-trimethylindolin-5-yl)ethyl]isoindoline-5-carboxylic acid CAS Name: 6-ethoxy-3-imino-2-[2-oxo-2-(1,3,3-trimethyl-2H-indol-5-yl)ethyl]-1H-isoindole-5-carboxylic acid IUPAC Name: 6-ethoxy-3-imino-2-[2-oxo-2-(1,3,3-trimethyl-2H-indol-5-yl)ethyl]-1H-isoindole-5-carboxylic acid Traditional Name: 6-ethoxy-3-imino-2-[2-keto-2-(1,3,3-trimethylindolin-5-yl)ethyl]isoindoline-5-carboxylic acid Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CN(C2=N)CC(=O)C3=CC4=C(C=C3)N(CC4(C)C)C)C(=O)O

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CN(C2=N)CC(=O)C3=CC4=C(C=C3)N(CC4(C)C)C)C(=O)O

InChI

InChI=1S/C24H27N3O4/c1-5-31-21-9-15-11-27(22(25)16(15)10-17(21)23(29)30)12-20(28)14-6-7-19-18(8-14)24(2,3)13-26(19)4/h6-10,25H,5,11-13H2,1-4H3,(H,29,30)