1-[3-methoxy-4-[2-methoxy-4-(3-oxidanylidenebutanoyl)phenoxy]phenyl]butane-1,3-dione

Systemtic Name: 1-[3-methoxy-4-[2-methoxy-4-(3-oxidanylidenebutanoyl)phenoxy]phenyl]butane-1,3-dione Openeye Name: 1-[3-methoxy-4-[2-methoxy-4-(3-oxobutanoyl)phenoxy]phenyl]butane-1,3-dione CAS Name: 1-[4-[4-(1,3-dioxobutyl)-2-methoxyphenoxy]-3-methoxyphenyl]butane-1,3-dione IUPAC Name: 1-[3-methoxy-4-[2-methoxy-4-(3-oxobutanoyl)phenoxy]phenyl]butane-1,3-dione Traditional Name: 1-[4-(4-acetoacetyl-2-methoxy-phenoxy)-3-methoxy-phenyl]butane-1,3-dione Formula: C22H22O7 MolecularWeight: 398.40588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)C(=O)CC(=O)C)OC)OC

Isomeric SMILES

CC(=O)CC(=O)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)C(=O)CC(=O)C)OC)OC

InChI

InChI=1S/C22H22O7/c1-13(23)9-17(25)15-5-7-19(21(11-15)27-3)29-20-8-6-16(12-22(20)28-4)18(26)10-14(2)24/h5-8,11-12H,9-10H2,1-4H3