methylbenzene; (Z)-2-oxidanylpent-2-enoate

Systemtic Name: methylbenzene; (Z)-2-oxidanylpent-2-enoate Openeye Name: (Z)-2-hydroxypent-2-enoate; toluene CAS Name: (Z)-2-hydroxy-2-pentenoate; toluene IUPAC Name: (Z)-2-hydroxypent-2-enoate; toluene Traditional Name: (Z)-2-hydroxypent-2-enoate; toluene Formula: C12H15O3- MolecularWeight: 207.2457

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C(C(=O)[O-])O.CC1=CC=CC=C1

Isomeric SMILES

CC/C=C(/C(=O)[O-])\O.CC1=CC=CC=C1

InChI

InChI=1S/C7H8.C5H8O3/c1-7-5-3-2-4-6-7;1-2-3-4(6)5(7)8/h2-6H,1H3;3,6H,2H2,1H3,(H,7,8)/p-1/b;4-3-