ethenylbenzene; furan-2,5-dione; (Z)-4-methoxy-4-oxidanylidene-but-2-enoic acid

Systemtic Name: ethenylbenzene; furan-2,5-dione; (Z)-4-methoxy-4-oxidanylidene-but-2-enoic acid Openeye Name: furan-2,5-dione; (Z)-4-methoxy-4-oxo-but-2-enoic acid; styrene CAS Name: furan-2,5-dione; (Z)-4-methoxy-4-oxo-2-butenoic acid; styrene IUPAC Name: furan-2,5-dione; (Z)-4-methoxy-4-oxobut-2-enoic acid; styrene Traditional Name: furan-2,5-quinone; (Z)-4-keto-4-methoxy-but-2-enoic acid; styrene Formula: C17H16O7 MolecularWeight: 332.30474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC(=O)O.C=CC1=CC=CC=C1.C1=CC(=O)OC1=O

Isomeric SMILES

COC(=O)/C=C\C(=O)O.C=CC1=CC=CC=C1.C1=CC(=O)OC1=O

InChI

InChI=1S/C8H8.C5H6O4.C4H2O3/c1-2-8-6-4-3-5-7-8;1-9-5(8)3-2-4(6)7;5-3-1-2-4(6)7-3/h2-7H,1H2;2-3H,1H3,(H,6,7);1-2H/b;3-2-;