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

Systemtic Name: 3-azanylidene-6-ethoxy-2-[2-oxidanylidene-2-(1,4,4-trimethyl-2-oxidanylidene-3H-quinolin-6-yl)ethyl]-1H-isoindole-5-carboxylic acid Openeye Name: 6-ethoxy-3-imino-2-[2-oxo-2-(1,4,4-trimethyl-2-oxo-3H-quinolin-6-yl)ethyl]isoindoline-5-carboxylic acid CAS Name: 6-ethoxy-3-imino-2-[2-oxo-2-(1,4,4-trimethyl-2-oxo-3H-quinolin-6-yl)ethyl]-1H-isoindole-5-carboxylic acid IUPAC Name: 6-ethoxy-3-imino-2-[2-oxo-2-(1,4,4-trimethyl-2-oxo-3H-quinolin-6-yl)ethyl]-1H-isoindole-5-carboxylic acid Traditional Name: 6-ethoxy-3-imino-2-[2-keto-2-(2-keto-1,4,4-trimethyl-3H-quinolin-6-yl)ethyl]isoindoline-5-carboxylic acid Formula: C25H27N3O5 MolecularWeight: 449.49898

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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(C(=O)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(C(=O)CC4(C)C)C)C(=O)O

InChI

InChI=1S/C25H27N3O5/c1-5-33-21-9-15-12-28(23(26)16(15)10-17(21)24(31)32)13-20(29)14-6-7-19-18(8-14)25(2,3)11-22(30)27(19)4/h6-10,26H,5,11-13H2,1-4H3,(H,31,32)