propan-2-yl 4-[[2,5-bis(oxidanyl)phenyl]methylamino]-2-chloranyl-benzoate

Systemtic Name: propan-2-yl 4-[[2,5-bis(oxidanyl)phenyl]methylamino]-2-chloranyl-benzoate Openeye Name: isopropyl 2-chloro-4-[(2,5-dihydroxyphenyl)methylamino]benzoate CAS Name: 2-chloro-4-[(2,5-dihydroxyphenyl)methylamino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-chloro-4-[(2,5-dihydroxyphenyl)methylamino]benzoate Traditional Name: 2-chloro-4-[(2,5-dihydroxybenzyl)amino]benzoic acid isopropyl ester Formula: C17H18ClNO4 MolecularWeight: 335.78212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(C=C(C=C1)NCC2=C(C=CC(=C2)O)O)Cl

Isomeric SMILES

CC(C)OC(=O)C1=C(C=C(C=C1)NCC2=C(C=CC(=C2)O)O)Cl

InChI

InChI=1S/C17H18ClNO4/c1-10(2)23-17(22)14-5-3-12(8-15(14)18)19-9-11-7-13(20)4-6-16(11)21/h3-8,10,19-21H,9H2,1-2H3