(7-oxidanylidenebenzo[a]phenalen-3-yl) butanoate

Systemtic Name: (7-oxidanylidenebenzo[a]phenalen-3-yl) butanoate Openeye Name: (7-oxobenzo[a]phenalen-3-yl) butanoate CAS Name: butanoic acid (7-oxo-3-benzo[a]phenalenyl) ester IUPAC Name: (7-oxobenzo[a]phenalen-3-yl) butanoate Traditional Name: butyric acid (7-ketobenzo[a]phenalen-3-yl) ester Formula: C21H16O3 MolecularWeight: 316.34994

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C2C=CC=C3C2=C(C=C1)C4=CC=CC=C4C3=O

Isomeric SMILES

CCCC(=O)OC1=C2C=CC=C3C2=C(C=C1)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H16O3/c1-2-6-19(22)24-18-12-11-14-13-7-3-4-8-15(13)21(23)17-10-5-9-16(18)20(14)17/h3-5,7-12H,2,6H2,1H3