[4-ethoxy-2-(2-ethoxy-2-oxidanylidene-ethoxy)-5-ethyl-phenyl] 2-[(4-carbamimidoylphenyl)amino]ethanoate ethanoate

Systemtic Name: [4-ethoxy-2-(2-ethoxy-2-oxidanylidene-ethoxy)-5-ethyl-phenyl] 2-[(4-carbamimidoylphenyl)amino]ethanoate ethanoate Openeye Name: [4-ethoxy-2-(2-ethoxy-2-oxo-ethoxy)-5-ethyl-phenyl] 2-(4-carbamimidoylanilino)acetate acetate CAS Name: 2-(4-carbamimidoylanilino)acetic acid [4-ethoxy-2-(2-ethoxy-2-oxoethoxy)-5-ethylphenyl] ester acetate IUPAC Name: [4-ethoxy-2-(2-ethoxy-2-oxoethoxy)-5-ethylphenyl] 2-(4-carbamimidoylanilino)acetate acetate Traditional Name: 2-(4-amidinoanilino)acetic acid [4-ethoxy-2-(2-ethoxy-2-keto-ethoxy)-5-ethyl-phenyl] ester acetate Formula: C25H32N3O8- MolecularWeight: 502.53688

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1OCC)OCC(=O)OCC)OC(=O)CNC2=CC=C(C=C2)C(=N)N.CC(=O)[O-]

Isomeric SMILES

CCC1=CC(=C(C=C1OCC)OCC(=O)OCC)OC(=O)CNC2=CC=C(C=C2)C(=N)N.CC(=O)[O-]

InChI

InChI=1S/C23H29N3O6.C2H4O2/c1-4-15-11-20(19(12-18(15)29-5-2)31-14-22(28)30-6-3)32-21(27)13-26-17-9-7-16(8-10-17)23(24)25;1-2(3)4/h7-12,26H,4-6,13-14H2,1-3H3,(H3,24,25);1H3,(H,3,4)/p-1