2-(2-carbamimidoylphenoxy)-3-[3-(dimethylamino)phenoxy]pyridine-4-carboxamide hydrochloride

Systemtic Name: 2-(2-carbamimidoylphenoxy)-3-[3-(dimethylamino)phenoxy]pyridine-4-carboxamide hydrochloride Openeye Name: 2-(2-carbamimidoylphenoxy)-3-[3-(dimethylamino)phenoxy]pyridine-4-carboxamide hydrochloride CAS Name: 2-(2-carbamimidoylphenoxy)-3-[3-(dimethylamino)phenoxy]-4-pyridinecarboxamide hydrochloride IUPAC Name: 2-(2-carbamimidoylphenoxy)-3-[3-(dimethylamino)phenoxy]pyridine-4-carboxamide hydrochloride Traditional Name: 2-(2-amidinophenoxy)-3-[3-(dimethylamino)phenoxy]isonicotinamide hydrochloride Formula: C21H22ClN5O3 MolecularWeight: 427.88408

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=CC=C1)OC2=C(C=CN=C2OC3=CC=CC=C3C(=N)N)C(=O)N.Cl

Isomeric SMILES

CN(C)C1=CC(=CC=C1)OC2=C(C=CN=C2OC3=CC=CC=C3C(=N)N)C(=O)N.Cl

InChI

InChI=1S/C21H21N5O3.ClH/c1-26(2)13-6-5-7-14(12-13)28-18-16(20(24)27)10-11-25-21(18)29-17-9-4-3-8-15(17)19(22)23;/h3-12H,1-2H3,(H3,22,23)(H2,24,27);1H