(E)-6-oxidanylidene-7-(pent-4-enoylamino)oct-4-enoic acid

Systemtic Name: (E)-6-oxidanylidene-7-(pent-4-enoylamino)oct-4-enoic acid Openeye Name: (E)-6-oxo-7-(pent-4-enoylamino)oct-4-enoic acid CAS Name: (E)-6-oxo-7-(1-oxopent-4-enylamino)-4-octenoic acid IUPAC Name: (E)-6-oxo-7-(pent-4-enoylamino)oct-4-enoic acid Traditional Name: (E)-6-keto-7-(pent-4-enoylamino)oct-4-enoic acid Formula: C13H19NO4 MolecularWeight: 253.29426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C=CCCC(=O)O)NC(=O)CCC=C

Isomeric SMILES

CC(C(=O)/C=C/CCC(=O)O)NC(=O)CCC=C

InChI

InChI=1S/C13H19NO4/c1-3-4-8-12(16)14-10(2)11(15)7-5-6-9-13(17)18/h3,5,7,10H,1,4,6,8-9H2,2H3,(H,14,16)(H,17,18)/b7-5+