ethyl 2-(3-carbamimidoylphenoxy)-6-(5-cyano-2-phenylmethoxy-phenoxy)pyridine-4-carboxylate

Systemtic Name: ethyl 2-(3-carbamimidoylphenoxy)-6-(5-cyano-2-phenylmethoxy-phenoxy)pyridine-4-carboxylate Openeye Name: ethyl 2-(2-benzyloxy-5-cyano-phenoxy)-6-(3-carbamimidoylphenoxy)pyridine-4-carboxylate CAS Name: 2-(3-carbamimidoylphenoxy)-6-(5-cyano-2-phenylmethoxyphenoxy)-4-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(3-carbamimidoylphenoxy)-6-(5-cyano-2-phenylmethoxyphenoxy)pyridine-4-carboxylate Traditional Name: 2-(3-amidinophenoxy)-6-(2-benzoxy-5-cyano-phenoxy)isonicotinic acid ethyl ester Formula: C29H24N4O5 MolecularWeight: 508.52466

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NC(=C1)OC2=C(C=CC(=C2)C#N)OCC3=CC=CC=C3)OC4=CC=CC(=C4)C(=N)N

Isomeric SMILES

CCOC(=O)C1=CC(=NC(=C1)OC2=C(C=CC(=C2)C#N)OCC3=CC=CC=C3)OC4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C29H24N4O5/c1-2-35-29(34)22-15-26(37-23-10-6-9-21(14-23)28(31)32)33-27(16-22)38-25-13-20(17-30)11-12-24(25)36-18-19-7-4-3-5-8-19/h3-16H,2,18H2,1H3,(H3,31,32)