5-azanyl-2-[[4-(2-chloroethyl)phenyl]amino]benzoic acid

Systemtic Name: 5-azanyl-2-[[4-(2-chloroethyl)phenyl]amino]benzoic acid Openeye Name: 5-amino-2-[4-(2-chloroethyl)anilino]benzoic acid CAS Name: 5-amino-2-[4-(2-chloroethyl)anilino]benzoic acid IUPAC Name: 5-amino-2-[4-(2-chloroethyl)anilino]benzoic acid Traditional Name: 5-amino-2-[4-(2-chloroethyl)anilino]benzoic acid Formula: C15H15ClN2O2 MolecularWeight: 290.7448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCl)NC2=C(C=C(C=C2)N)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCCl)NC2=C(C=C(C=C2)N)C(=O)O

InChI

InChI=1S/C15H15ClN2O2/c16-8-7-10-1-4-12(5-2-10)18-14-6-3-11(17)9-13(14)15(19)20/h1-6,9,18H,7-8,17H2,(H,19,20)