methyl 4-[2-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-phenyl]carbonylamino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-phenyl]carbonylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[[4-(2-amino-2-oxo-ethoxy)-3-chloro-5-methoxy-benzoyl]amino]ethyl]benzoate CAS Name: 4-[2-[[[4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxyphenyl]-oxomethyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxybenzoyl]amino]ethyl]benzoate Traditional Name: 4-[2-[[4-(2-amino-2-keto-ethoxy)-3-chloro-5-methoxy-benzoyl]amino]ethyl]benzoic acid methyl ester Formula: C20H21ClN2O6 MolecularWeight: 420.84354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)NCCC2=CC=C(C=C2)C(=O)OC)Cl)OCC(=O)N

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)NCCC2=CC=C(C=C2)C(=O)OC)Cl)OCC(=O)N

InChI

InChI=1S/C20H21ClN2O6/c1-27-16-10-14(9-15(21)18(16)29-11-17(22)24)19(25)23-8-7-12-3-5-13(6-4-12)20(26)28-2/h3-6,9-10H,7-8,11H2,1-2H3,(H2,22,24)(H,23,25)