O1-ethyl O4-[(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl] (E)-but-2-enedioate

Systemtic Name: O1-ethyl O4-[(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl] (E)-but-2-enedioate Openeye Name: O1-ethyl O4-[(7-ethyl-2-oxo-chromen-4-yl)methyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-ethyl ester O4-[(7-ethyl-2-oxo-1-benzopyran-4-yl)methyl] ester IUPAC Name: 1-O-ethyl 4-O-[(7-ethyl-2-oxochromen-4-yl)methyl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O1-ethyl ester O4-[(7-ethyl-2-keto-chromen-4-yl)methyl] ester Formula: C18H18O6 MolecularWeight: 330.33192

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C=CC(=O)OCC

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)/C=C/C(=O)OCC

InChI

InChI=1S/C18H18O6/c1-3-12-5-6-14-13(10-18(21)24-15(14)9-12)11-23-17(20)8-7-16(19)22-4-2/h5-10H,3-4,11H2,1-2H3/b8-7+