ethyl 2,6-bis(3-carbamimidoylphenoxy)pyridine-3-carboxylate

Systemtic Name: ethyl 2,6-bis(3-carbamimidoylphenoxy)pyridine-3-carboxylate Openeye Name: ethyl 2,6-bis(3-carbamimidoylphenoxy)pyridine-3-carboxylate CAS Name: 2,6-bis(3-carbamimidoylphenoxy)-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2,6-bis(3-carbamimidoylphenoxy)pyridine-3-carboxylate Traditional Name: 2,6-bis(3-amidinophenoxy)nicotinic acid ethyl ester Formula: C22H21N5O4 MolecularWeight: 419.43324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C=C1)OC2=CC=CC(=C2)C(=N)N)OC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CCOC(=O)C1=C(N=C(C=C1)OC2=CC=CC(=C2)C(=N)N)OC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C22H21N5O4/c1-2-29-22(28)17-9-10-18(30-15-7-3-5-13(11-15)19(23)24)27-21(17)31-16-8-4-6-14(12-16)20(25)26/h3-12H,2H2,1H3,(H3,23,24)(H3,25,26)