buta-1,3-diene; prop-2-enenitrile; prop-2-enoic acid

Systemtic Name: buta-1,3-diene; prop-2-enenitrile; prop-2-enoic acid Openeye Name: acrylic acid; buta-1,3-diene; prop-2-enenitrile CAS Name: buta-1,3-diene; 2-propenenitrile; 2-propenoic acid IUPAC Name: buta-1,3-diene; prop-2-enenitrile; prop-2-enoic acid Traditional Name: acrylic acid; acrylonitrile; buta-1,3-diene Formula: C10H13NO2 MolecularWeight: 179.21572

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Descriptors Computed from Structure

Canonical SMILES:

C=CC=C.C=CC#N.C=CC(=O)O

Isomeric SMILES

C=CC=C.C=CC#N.C=CC(=O)O

InChI

InChI=1S/C4H6.C3H3N.C3H4O2/c1-3-4-2;1-2-3-4;1-2-3(4)5/h3-4H,1-2H2;2H,1H2;2H,1H2,(H,4,5)