(4Z)-4-butylideneisochromene-1,3-dione

Systemtic Name: (4Z)-4-butylideneisochromene-1,3-dione Openeye Name: (4Z)-4-butylideneisochromane-1,3-dione CAS Name: (4Z)-4-butylidene-3,4-dihydro-1H-2-benzopyran-1,3-dione IUPAC Name: (4Z)-4-butylideneisochromene-1,3-dione Traditional Name: (4Z)-4-butylideneisochroman-1,3-quinone Formula: C13H12O3 MolecularWeight: 216.23258

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=C1C2=CC=CC=C2C(=O)OC1=O

Isomeric SMILES

CCC/C=C\1/C2=CC=CC=C2C(=O)OC1=O

InChI

InChI=1S/C13H12O3/c1-2-3-6-10-9-7-4-5-8-11(9)13(15)16-12(10)14/h4-8H,2-3H2,1H3/b10-6-