buta-1,3-diene; (2E)-penta-2,4-dien-1-ol; prop-2-enenitrile

Systemtic Name: buta-1,3-diene; (2E)-penta-2,4-dien-1-ol; prop-2-enenitrile Openeye Name: buta-1,3-diene; (2E)-penta-2,4-dien-1-ol; prop-2-enenitrile CAS Name: buta-1,3-diene; (2E)-1-penta-2,4-dienol; 2-propenenitrile IUPAC Name: buta-1,3-diene; (2E)-penta-2,4-dien-1-ol; prop-2-enenitrile Traditional Name: acrylonitrile; buta-1,3-diene; (2E)-penta-2,4-dien-1-ol Formula: C12H17NO MolecularWeight: 191.26948

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Descriptors Computed from Structure

Canonical SMILES:

C=CC=C.C=CC=CCO.C=CC#N

Isomeric SMILES

C=CC=C.C=C/C=C/CO.C=CC#N

InChI

InChI=1S/C5H8O.C4H6.C3H3N/c1-2-3-4-5-6;1-3-4-2;1-2-3-4/h2-4,6H,1,5H2;3-4H,1-2H2;2H,1H2/b4-3+;;