ethyl 2-[[(E)-2-(2-azidoethanoylcarbamoyl)-3-oxidanylidene-but-1-enyl]amino]pyridine-3-carboxylate

Systemtic Name: ethyl 2-[[(E)-2-(2-azidoethanoylcarbamoyl)-3-oxidanylidene-but-1-enyl]amino]pyridine-3-carboxylate Openeye Name: ethyl 2-[[(E)-2-[(2-azidoacetyl)carbamoyl]-3-oxo-but-1-enyl]amino]pyridine-3-carboxylate CAS Name: 2-[[(E)-2-[[(2-azido-1-oxoethyl)amino]-oxomethyl]-3-oxobut-1-enyl]amino]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-2-[(2-azidoacetyl)carbamoyl]-3-oxobut-1-enyl]amino]pyridine-3-carboxylate Traditional Name: 2-[[(E)-2-[(2-azidoacetyl)carbamoyl]-3-keto-but-1-enyl]amino]nicotinic acid ethyl ester Formula: C15H16N6O5 MolecularWeight: 360.32474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=CC=C1)NC=C(C(=O)C)C(=O)NC(=O)CN=[N+]=[N-]

Isomeric SMILES

CCOC(=O)C1=C(N=CC=C1)N/C=C(\C(=O)C)/C(=O)NC(=O)CN=[N+]=[N-]

InChI

InChI=1S/C15H16N6O5/c1-3-26-15(25)10-5-4-6-17-13(10)18-7-11(9(2)22)14(24)20-12(23)8-19-21-16/h4-7H,3,8H2,1-2H3,(H,17,18)(H,20,23,24)/b11-7+