4-[[3-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]-3-oxidanyl-prop-1-enyl]amino]benzoate

Systemtic Name: 4-[[3-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]-3-oxidanyl-prop-1-enyl]amino]benzoate Openeye Name: 4-[[3-(4,4-dimethyl-2,6-dioxo-cyclohexylidene)-3-hydroxy-prop-1-enyl]amino]benzoate CAS Name: 4-[[3-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-hydroxyprop-1-enyl]amino]benzoate IUPAC Name: 4-[[3-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-hydroxyprop-1-enyl]amino]benzoate Traditional Name: 4-[[3-(2,6-diketo-4,4-dimethyl-cyclohexylidene)-3-hydroxy-prop-1-enyl]amino]benzoate Formula: C18H18NO5- MolecularWeight: 328.33922

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=C(C=CNC2=CC=C(C=C2)C(=O)[O-])O)C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=C(C=CNC2=CC=C(C=C2)C(=O)[O-])O)C(=O)C1)C

InChI

InChI=1S/C18H19NO5/c1-18(2)9-14(21)16(15(22)10-18)13(20)7-8-19-12-5-3-11(4-6-12)17(23)24/h3-8,19-20H,9-10H2,1-2H3,(H,23,24)/p-1