N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(2-oxidanylidene-3-phenylazanyl-pyridin-1-yl)ethanamide; ethanoic acid

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-2-(2-oxidanylidene-3-phenylazanyl-pyridin-1-yl)ethanamide; ethanoic acid Openeye Name: acetic acid; 2-(3-anilino-2-oxo-1-pyridyl)-N-[(4-carbamimidoylphenyl)methyl]-2-ethoxy-acetamide CAS Name: acetic acid; 2-(3-anilino-2-oxo-1-pyridinyl)-N-[(4-carbamimidoylphenyl)methyl]-2-ethoxyacetamide IUPAC Name: acetic acid; 2-(3-anilino-2-oxopyridin-1-yl)-N-[(4-carbamimidoylphenyl)methyl]-2-ethoxyacetamide Traditional Name: acetic acid; N-(4-amidinobenzyl)-2-(3-anilino-2-keto-1-pyridyl)-2-ethoxy-acetamide Formula: C25H29N5O5 MolecularWeight: 479.52826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(=O)NCC1=CC=C(C=C1)C(=N)N)N2C=CC=C(C2=O)NC3=CC=CC=C3.CC(=O)O

Isomeric SMILES

CCOC(C(=O)NCC1=CC=C(C=C1)C(=N)N)N2C=CC=C(C2=O)NC3=CC=CC=C3.CC(=O)O

InChI

InChI=1S/C23H25N5O3.C2H4O2/c1-2-31-23(21(29)26-15-16-10-12-17(13-11-16)20(24)25)28-14-6-9-19(22(28)30)27-18-7-4-3-5-8-18;1-2(3)4/h3-14,23,27H,2,15H2,1H3,(H3,24,25)(H,26,29);1H3,(H,3,4)