2-[[2-[2-(3,4-diethoxyphenyl)ethanoyl]-3-oxidanylidene-cyclohexen-1-yl]amino]ethanoic acid

Systemtic Name: 2-[[2-[2-(3,4-diethoxyphenyl)ethanoyl]-3-oxidanylidene-cyclohexen-1-yl]amino]ethanoic acid Openeye Name: 2-[[2-[2-(3,4-diethoxyphenyl)acetyl]-3-oxo-cyclohexen-1-yl]amino]acetic acid CAS Name: 2-[[2-[2-(3,4-diethoxyphenyl)-1-oxoethyl]-3-oxo-1-cyclohexenyl]amino]acetic acid IUPAC Name: 2-[[2-[2-(3,4-diethoxyphenyl)acetyl]-3-oxocyclohexen-1-yl]amino]acetic acid Traditional Name: 2-[[2-[2-(3,4-diethoxyphenyl)acetyl]-3-keto-cyclohexen-1-yl]amino]acetic acid Formula: C20H25NO6 MolecularWeight: 375.4156

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CC(=O)C2=C(CCCC2=O)NCC(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CC(=O)C2=C(CCCC2=O)NCC(=O)O)OCC

InChI

InChI=1S/C20H25NO6/c1-3-26-17-9-8-13(11-18(17)27-4-2)10-16(23)20-14(21-12-19(24)25)6-5-7-15(20)22/h8-9,11,21H,3-7,10,12H2,1-2H3,(H,24,25)