(E)-2-methyl-3-(prop-2-enoylamino)prop-2-enoic acid; pent-4-enoic acid

Systemtic Name: (E)-2-methyl-3-(prop-2-enoylamino)prop-2-enoic acid; pent-4-enoic acid Openeye Name: (E)-2-methyl-3-(prop-2-enoylamino)prop-2-enoic acid; pent-4-enoic acid CAS Name: (E)-2-methyl-3-(1-oxoprop-2-enylamino)-2-propenoic acid; 4-pentenoic acid IUPAC Name: (E)-2-methyl-3-(prop-2-enoylamino)prop-2-enoic acid; pent-4-enoic acid Traditional Name: (E)-3-acrylamido-2-methyl-acrylic acid; pent-4-enoic acid Formula: C12H17NO5 MolecularWeight: 255.26708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CNC(=O)C=C)C(=O)O.C=CCCC(=O)O

Isomeric SMILES

C/C(=C\NC(=O)C=C)/C(=O)O.C=CCCC(=O)O

InChI

InChI=1S/C7H9NO3.C5H8O2/c1-3-6(9)8-4-5(2)7(10)11;1-2-3-4-5(6)7/h3-4H,1H2,2H3,(H,8,9)(H,10,11);2H,1,3-4H2,(H,6,7)/b5-4+;