but-3-en-2-one; methyl (E)-but-2-enoate

Systemtic Name: but-3-en-2-one; methyl (E)-but-2-enoate Openeye Name: but-3-en-2-one; methyl (E)-but-2-enoate CAS Name: (E)-2-butenoic acid methyl ester; 3-buten-2-one IUPAC Name: but-3-en-2-one; methyl (E)-but-2-enoate Traditional Name: (E)-but-2-enoic acid methyl ester; but-3-en-2-one Formula: C9H14O3 MolecularWeight: 170.20566

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)OC.CC(=O)C=C

Isomeric SMILES

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

InChI

InChI=1S/C5H8O2.C4H6O/c1-3-4-5(6)7-2;1-3-4(2)5/h3-4H,1-2H3;3H,1H2,2H3/b4-3+;