(Z)-2-ethylbut-2-enal; (Z)-2-ethylbut-2-enoic acid

Systemtic Name: (Z)-2-ethylbut-2-enal; (Z)-2-ethylbut-2-enoic acid Openeye Name: (Z)-2-ethylbut-2-enal; (Z)-2-ethylbut-2-enoic acid CAS Name: (Z)-2-ethyl-2-butenal; (Z)-2-ethyl-2-butenoic acid IUPAC Name: (Z)-2-ethylbut-2-enal; (Z)-2-ethylbut-2-enoic acid Traditional Name: (Z)-2-ethylbut-2-enal; (Z)-2-ethylbut-2-enoic acid Formula: C12H20O3 MolecularWeight: 212.2854

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC)C=O.CCC(=CC)C(=O)O

Isomeric SMILES

CC/C(=C/C)/C=O.CC/C(=C/C)/C(=O)O

InChI

InChI=1S/C6H10O2.C6H10O/c1-3-5(4-2)6(7)8;1-3-6(4-2)5-7/h3H,4H2,1-2H3,(H,7,8);3,5H,4H2,1-2H3/b5-3-;6-3-