4-chloranyl-2-[(2-prop-2-enoxycarbonylphenyl)methylamino]benzoic acid

Systemtic Name: 4-chloranyl-2-[(2-prop-2-enoxycarbonylphenyl)methylamino]benzoic acid Openeye Name: 2-[(2-allyloxycarbonylphenyl)methylamino]-4-chloro-benzoic acid CAS Name: 4-chloro-2-[[2-[oxo(prop-2-enoxy)methyl]phenyl]methylamino]benzoic acid IUPAC Name: 4-chloro-2-[(2-prop-2-enoxycarbonylphenyl)methylamino]benzoic acid Traditional Name: 2-[(2-allyloxycarbonylbenzyl)amino]-4-chloro-benzoic acid Formula: C18H16ClNO4 MolecularWeight: 345.77694

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C1=CC=CC=C1CNC2=C(C=CC(=C2)Cl)C(=O)O

Isomeric SMILES

C=CCOC(=O)C1=CC=CC=C1CNC2=C(C=CC(=C2)Cl)C(=O)O

InChI

InChI=1S/C18H16ClNO4/c1-2-9-24-18(23)14-6-4-3-5-12(14)11-20-16-10-13(19)7-8-15(16)17(21)22/h2-8,10,20H,1,9,11H2,(H,21,22)