butyl 4-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-phenyl]methylamino]benzoate

Systemtic Name: butyl 4-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-phenyl]methylamino]benzoate Openeye Name: butyl 4-[[4-(2-amino-2-oxo-ethoxy)-3-chloro-5-methoxy-phenyl]methylamino]benzoate CAS Name: 4-[[4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxyphenyl]methylamino]benzoic acid butyl ester IUPAC Name: butyl 4-[[4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxyphenyl]methylamino]benzoate Traditional Name: 4-[[4-(2-amino-2-keto-ethoxy)-3-chloro-5-methoxy-benzyl]amino]benzoic acid butyl ester Formula: C21H25ClN2O5 MolecularWeight: 420.8866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NCC2=CC(=C(C(=C2)Cl)OCC(=O)N)OC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NCC2=CC(=C(C(=C2)Cl)OCC(=O)N)OC

InChI

InChI=1S/C21H25ClN2O5/c1-3-4-9-28-21(26)15-5-7-16(8-6-15)24-12-14-10-17(22)20(18(11-14)27-2)29-13-19(23)25/h5-8,10-11,24H,3-4,9,12-13H2,1-2H3,(H2,23,25)