methyl 5-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methylamino]-2-morpholin-4-yl-benzoate

Systemtic Name: methyl 5-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methylamino]-2-morpholin-4-yl-benzoate Openeye Name: methyl 5-[[4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]methylamino]-2-morpholino-benzoate CAS Name: 5-[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methylamino]-2-(4-morpholinyl)benzoic acid methyl ester IUPAC Name: methyl 5-[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methylamino]-2-morpholin-4-ylbenzoate Traditional Name: 5-[[4-(2-amino-2-keto-ethoxy)-3-methoxy-benzyl]amino]-2-morpholino-benzoic acid methyl ester Formula: C22H27N3O6 MolecularWeight: 429.46628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC2=CC(=C(C=C2)N3CCOCC3)C(=O)OC)OCC(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)CNC2=CC(=C(C=C2)N3CCOCC3)C(=O)OC)OCC(=O)N

InChI

InChI=1S/C22H27N3O6/c1-28-20-11-15(3-6-19(20)31-14-21(23)26)13-24-16-4-5-18(17(12-16)22(27)29-2)25-7-9-30-10-8-25/h3-6,11-12,24H,7-10,13-14H2,1-2H3,(H2,23,26)