methyl 2-[3-(6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)propanoylamino]-4,5-dimethoxy-benzoate

Systemtic Name: methyl 2-[3-(6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)propanoylamino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)propanoylamino]-4,5-dimethoxy-benzoate CAS Name: 2-[[3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-1-oxopropyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)propanoylamino]-4,5-dimethoxybenzoate Traditional Name: 2-[3-(6-chloro-2-keto-1,3-benzoxazol-3-yl)propanoylamino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C20H19ClN2O7 MolecularWeight: 434.82706

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CCN2C3=C(C=C(C=C3)Cl)OC2=O)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CCN2C3=C(C=C(C=C3)Cl)OC2=O)OC

InChI

InChI=1S/C20H19ClN2O7/c1-27-16-9-12(19(25)29-3)13(10-17(16)28-2)22-18(24)6-7-23-14-5-4-11(21)8-15(14)30-20(23)26/h4-5,8-10H,6-7H2,1-3H3,(H,22,24)