2-[[(2E,4E)-6-methylhepta-2,4-dienoyl]amino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[[(2E,4E)-6-methylhepta-2,4-dienoyl]amino]-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-[[(2E,4E)-6-methylhepta-2,4-dienoyl]amino]propanoic acid CAS Name: 3-hydroxy-2-[[(2E,4E)-6-methyl-1-oxohepta-2,4-dienyl]amino]propanoic acid IUPAC Name: 3-hydroxy-2-[[(2E,4E)-6-methylhepta-2,4-dienoyl]amino]propanoic acid Traditional Name: 3-hydroxy-2-[[(2E,4E)-6-methylhepta-2,4-dienoyl]amino]propionic acid Formula: C11H17NO4 MolecularWeight: 227.25698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C=CC=CC(=O)NC(CO)C(=O)O

Isomeric SMILES

CC(C)/C=C/C=C/C(=O)NC(CO)C(=O)O

InChI

InChI=1S/C11H17NO4/c1-8(2)5-3-4-6-10(14)12-9(7-13)11(15)16/h3-6,8-9,13H,7H2,1-2H3,(H,12,14)(H,15,16)/b5-3+,6-4+