butyl 3-butyl-1,4-bis(oxidanylidene)isochromene-3-carboxylate

Systemtic Name: butyl 3-butyl-1,4-bis(oxidanylidene)isochromene-3-carboxylate Openeye Name: butyl 3-butyl-1,4-dioxo-isochromane-3-carboxylate CAS Name: 3-butyl-1,4-dioxo-3,4-dihydro-1H-2-benzopyran-3-carboxylic acid butyl ester IUPAC Name: butyl 3-butyl-1,4-dioxoisochromene-3-carboxylate Traditional Name: 3-butyl-1,4-diketo-isochroman-3-carboxylic acid butyl ester Formula: C18H22O5 MolecularWeight: 318.36428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=O)C2=CC=CC=C2C(=O)O1)C(=O)OCCCC

Isomeric SMILES

CCCCC1(C(=O)C2=CC=CC=C2C(=O)O1)C(=O)OCCCC

InChI

InChI=1S/C18H22O5/c1-3-5-11-18(17(21)22-12-6-4-2)15(19)13-9-7-8-10-14(13)16(20)23-18/h7-10H,3-6,11-12H2,1-2H3