1-[4-(3,4-dimethoxyphenyl)-2,6-bis(oxidanylidene)cyclohexylidene]butan-1-olate

Systemtic Name: 1-[4-(3,4-dimethoxyphenyl)-2,6-bis(oxidanylidene)cyclohexylidene]butan-1-olate Openeye Name: 1-[4-(3,4-dimethoxyphenyl)-2,6-dioxo-cyclohexylidene]butan-1-olate CAS Name: 1-[4-(3,4-dimethoxyphenyl)-2,6-dioxocyclohexylidene]-1-butanolate IUPAC Name: 1-[4-(3,4-dimethoxyphenyl)-2,6-dioxocyclohexylidene]butan-1-olate Traditional Name: 1-[4-(3,4-dimethoxyphenyl)-2,6-diketo-cyclohexylidene]butan-1-olate Formula: C18H21O5- MolecularWeight: 317.35634

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C1C(=O)CC(CC1=O)C2=CC(=C(C=C2)OC)OC)[O-]

Isomeric SMILES

CCCC(=C1C(=O)CC(CC1=O)C2=CC(=C(C=C2)OC)OC)[O-]

InChI

InChI=1S/C18H22O5/c1-4-5-13(19)18-14(20)8-12(9-15(18)21)11-6-7-16(22-2)17(10-11)23-3/h6-7,10,12,19H,4-5,8-9H2,1-3H3/p-1