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

Systemtic Name: ethyl 2-[4-[2-(6-carbamimidoyl-3-oxidanylidene-1H-isoindol-2-yl)ethanoyl]-3-oxidanyl-2-propyl-phenoxy]ethanoate Openeye Name: ethyl 2-[4-[2-(5-carbamimidoyl-1-oxo-isoindolin-2-yl)acetyl]-3-hydroxy-2-propyl-phenoxy]acetate CAS Name: 2-[4-[2-(6-carbamimidoyl-3-oxo-1H-isoindol-2-yl)-1-oxoethyl]-3-hydroxy-2-propylphenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[2-(6-carbamimidoyl-3-oxo-1H-isoindol-2-yl)acetyl]-3-hydroxy-2-propylphenoxy]acetate Traditional Name: 2-[4-[2-(5-amidino-1-keto-isoindolin-2-yl)acetyl]-3-hydroxy-2-propyl-phenoxy]acetic acid ethyl ester Formula: C24H27N3O6 MolecularWeight: 453.48768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)CN2CC3=C(C2=O)C=CC(=C3)C(=N)N)OCC(=O)OCC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)CN2CC3=C(C2=O)C=CC(=C3)C(=N)N)OCC(=O)OCC

InChI

InChI=1S/C24H27N3O6/c1-3-5-18-20(33-13-21(29)32-4-2)9-8-17(22(18)30)19(28)12-27-11-15-10-14(23(25)26)6-7-16(15)24(27)31/h6-10,30H,3-5,11-13H2,1-2H3,(H3,25,26)