ethyl 2-[4-[2-(6-carbamimidoyl-3-oxidanylidene-1H-isoindol-2-yl)ethanoyl]-2-(2-ethoxy-2-oxidanylidene-ethoxy)phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-[2-(6-carbamimidoyl-3-oxidanylidene-1H-isoindol-2-yl)ethanoyl]-2-(2-ethoxy-2-oxidanylidene-ethoxy)phenoxy]ethanoate Openeye Name: ethyl 2-[4-[2-(5-carbamimidoyl-1-oxo-isoindolin-2-yl)acetyl]-2-(2-ethoxy-2-oxo-ethoxy)phenoxy]acetate CAS Name: 2-[4-[2-(6-carbamimidoyl-3-oxo-1H-isoindol-2-yl)-1-oxoethyl]-2-(2-ethoxy-2-oxoethoxy)phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[2-(6-carbamimidoyl-3-oxo-1H-isoindol-2-yl)acetyl]-2-(2-ethoxy-2-oxoethoxy)phenoxy]acetate Traditional Name: 2-[4-[2-(5-amidino-1-keto-isoindolin-2-yl)acetyl]-2-(2-ethoxy-2-keto-ethoxy)phenoxy]acetic acid ethyl ester Formula: C25H27N3O8 MolecularWeight: 497.49718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=C(C=C1)C(=O)CN2CC3=C(C2=O)C=CC(=C3)C(=N)N)OCC(=O)OCC

Isomeric SMILES

CCOC(=O)COC1=C(C=C(C=C1)C(=O)CN2CC3=C(C2=O)C=CC(=C3)C(=N)N)OCC(=O)OCC

InChI

InChI=1S/C25H27N3O8/c1-3-33-22(30)13-35-20-8-6-15(10-21(20)36-14-23(31)34-4-2)19(29)12-28-11-17-9-16(24(26)27)5-7-18(17)25(28)32/h5-10H,3-4,11-14H2,1-2H3,(H3,26,27)