(E)-4-[[methyl(2-pyridin-2-ylethyl)carbamoyl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[methyl(2-pyridin-2-ylethyl)carbamoyl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[[methyl-[2-(2-pyridyl)ethyl]carbamoyl]amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[[methyl-[2-(2-pyridinyl)ethyl]amino]-oxomethyl]amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[[methyl(2-pyridin-2-ylethyl)carbamoyl]amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-[[methyl-[2-(2-pyridyl)ethyl]carbamoyl]amino]but-2-enoic acid Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)C(=O)NC(=O)C=CC(=O)O

Isomeric SMILES

CN(CCC1=CC=CC=N1)C(=O)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C13H15N3O4/c1-16(9-7-10-4-2-3-8-14-10)13(20)15-11(17)5-6-12(18)19/h2-6,8H,7,9H2,1H3,(H,18,19)(H,15,17,20)/b6-5+