1-ethoxycarbonyloxyethyl 3-[1-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]imidazol-4-yl]propanoate

Systemtic Name: 1-ethoxycarbonyloxyethyl 3-[1-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]imidazol-4-yl]propanoate Openeye Name: 1-ethoxycarbonyloxyethyl 3-[1-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]imidazol-4-yl]propanoate CAS Name: 3-[1-[6-(4-carbamimidoylphenyl)-3-pyridazinyl]-4-imidazolyl]propanoic acid 1-ethoxycarbonyloxyethyl ester IUPAC Name: 1-ethoxycarbonyloxyethyl 3-[1-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]imidazol-4-yl]propanoate Traditional Name: 3-[1-[6-(4-amidinophenyl)pyridazin-3-yl]imidazol-4-yl]propionic acid 1-carbethoxyoxyethyl ester Formula: C22H24N6O5 MolecularWeight: 452.46316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC(C)OC(=O)CCC1=CN(C=N1)C2=NN=C(C=C2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CCOC(=O)OC(C)OC(=O)CCC1=CN(C=N1)C2=NN=C(C=C2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C22H24N6O5/c1-3-31-22(30)33-14(2)32-20(29)11-8-17-12-28(13-25-17)19-10-9-18(26-27-19)15-4-6-16(7-5-15)21(23)24/h4-7,9-10,12-14H,3,8,11H2,1-2H3,(H3,23,24)