(E)-4-oxidanylidene-4-[[propan-2-yl(propyl)carbamoyl]amino]but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-[[propan-2-yl(propyl)carbamoyl]amino]but-2-enoic acid Openeye Name: (E)-4-[[isopropyl(propyl)carbamoyl]amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-oxo-4-[[oxo-[propan-2-yl(propyl)amino]methyl]amino]-2-butenoic acid IUPAC Name: (E)-4-oxo-4-[[propan-2-yl(propyl)carbamoyl]amino]but-2-enoic acid Traditional Name: (E)-4-[[isopropyl(propyl)carbamoyl]amino]-4-keto-but-2-enoic acid Formula: C11H18N2O4 MolecularWeight: 242.27162

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(C)C)C(=O)NC(=O)C=CC(=O)O

Isomeric SMILES

CCCN(C(C)C)C(=O)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C11H18N2O4/c1-4-7-13(8(2)3)11(17)12-9(14)5-6-10(15)16/h5-6,8H,4,7H2,1-3H3,(H,15,16)(H,12,14,17)/b6-5+