methyl 4-[[(3-chloranyl-4-oxidanyl-phenyl)carbonyl-methyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[(3-chloranyl-4-oxidanyl-phenyl)carbonyl-methyl-amino]methyl]benzoate Openeye Name: methyl 4-[[(3-chloro-4-hydroxy-benzoyl)-methyl-amino]methyl]benzoate CAS Name: 4-[[[(3-chloro-4-hydroxyphenyl)-oxomethyl]-methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(3-chloro-4-hydroxybenzoyl)-methylamino]methyl]benzoate Traditional Name: 4-[[(3-chloro-4-hydroxy-benzoyl)-methyl-amino]methyl]benzoic acid methyl ester Formula: C17H16ClNO4 MolecularWeight: 333.76624

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=CC(=C(C=C2)O)Cl

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=CC(=C(C=C2)O)Cl

InChI

InChI=1S/C17H16ClNO4/c1-19(16(21)13-7-8-15(20)14(18)9-13)10-11-3-5-12(6-4-11)17(22)23-2/h3-9,20H,10H2,1-2H3