[2-methoxy-4-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]phenyl] 4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-benzoate

Systemtic Name: [2-methoxy-4-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]phenyl] 4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-benzoate Openeye Name: [2-methoxy-4-[(E)-3-methoxy-3-oxo-prop-1-enyl]phenyl] 4-(2-amino-2-oxo-ethoxy)-3-chloro-5-methoxy-benzoate CAS Name: 4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxybenzoic acid [2-methoxy-4-[(E)-3-methoxy-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-3-methoxy-3-oxoprop-1-enyl]phenyl] 4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxybenzoate Traditional Name: 4-(2-amino-2-keto-ethoxy)-3-chloro-5-methoxy-benzoic acid [4-[(E)-3-keto-3-methoxy-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C21H20ClNO8 MolecularWeight: 449.8384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)OC)OC(=O)C2=CC(=C(C(=C2)Cl)OCC(=O)N)OC

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)OC)OC(=O)C2=CC(=C(C(=C2)Cl)OCC(=O)N)OC

InChI

InChI=1S/C21H20ClNO8/c1-27-16-8-12(5-7-19(25)29-3)4-6-15(16)31-21(26)13-9-14(22)20(17(10-13)28-2)30-11-18(23)24/h4-10H,11H2,1-3H3,(H2,23,24)/b7-5+