2-[[4-[(E)-4-methoxybut-3-enyl]phenyl]carbonylamino]pentanedioic acid

Systemtic Name: 2-[[4-[(E)-4-methoxybut-3-enyl]phenyl]carbonylamino]pentanedioic acid Openeye Name: 2-[[4-[(E)-4-methoxybut-3-enyl]benzoyl]amino]pentanedioic acid CAS Name: 2-[[[4-[(E)-4-methoxybut-3-enyl]phenyl]-oxomethyl]amino]pentanedioic acid IUPAC Name: 2-[[4-[(E)-4-methoxybut-3-enyl]benzoyl]amino]pentanedioic acid Traditional Name: 2-[[4-[(E)-4-methoxybut-3-enyl]benzoyl]amino]glutaric acid Formula: C17H21NO6 MolecularWeight: 335.35174

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Descriptors Computed from Structure

Canonical SMILES:

COC=CCCC1=CC=C(C=C1)C(=O)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

CO/C=C/CCC1=CC=C(C=C1)C(=O)NC(CCC(=O)O)C(=O)O

InChI

InChI=1S/C17H21NO6/c1-24-11-3-2-4-12-5-7-13(8-6-12)16(21)18-14(17(22)23)9-10-15(19)20/h3,5-8,11,14H,2,4,9-10H2,1H3,(H,18,21)(H,19,20)(H,22,23)/b11-3+