1-acetyloxyethyl 4-carbamimidoyl-2-(phenylcarbonyl)pyridine-3-carboxylate

Systemtic Name: 1-acetyloxyethyl 4-carbamimidoyl-2-(phenylcarbonyl)pyridine-3-carboxylate Openeye Name: 1-acetoxyethyl 2-benzoyl-4-carbamimidoyl-pyridine-3-carboxylate CAS Name: 2-benzoyl-4-carbamimidoyl-3-pyridinecarboxylic acid 1-acetyloxyethyl ester IUPAC Name: 1-acetyloxyethyl 2-benzoyl-4-carbamimidoylpyridine-3-carboxylate Traditional Name: 4-amidino-2-benzoyl-nicotinic acid 1-acetoxyethyl ester Formula: C18H17N3O5 MolecularWeight: 355.34468

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Descriptors Computed from Structure

Canonical SMILES:

CC(OC(=O)C)OC(=O)C1=C(C=CN=C1C(=O)C2=CC=CC=C2)C(=N)N

Isomeric SMILES

CC(OC(=O)C)OC(=O)C1=C(C=CN=C1C(=O)C2=CC=CC=C2)C(=N)N

InChI

InChI=1S/C18H17N3O5/c1-10(22)25-11(2)26-18(24)14-13(17(19)20)8-9-21-15(14)16(23)12-6-4-3-5-7-12/h3-9,11H,1-2H3,(H3,19,20)