4-[(3-aminophenyl)methylcarbamoyl]-2-bromanyl-benzoic acid

Systemtic Name: 4-[(3-aminophenyl)methylcarbamoyl]-2-bromanyl-benzoic acid Openeye Name: 4-[(3-aminophenyl)methylcarbamoyl]-2-bromo-benzoic acid CAS Name: 4-[[(3-aminophenyl)methylamino]-oxomethyl]-2-bromobenzoic acid IUPAC Name: 4-[(3-aminophenyl)methylcarbamoyl]-2-bromobenzoic acid Traditional Name: 4-[(3-aminobenzyl)carbamoyl]-2-bromo-benzoic acid Formula: C15H13BrN2O3 MolecularWeight: 349.17932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)CNC(=O)C2=CC(=C(C=C2)C(=O)O)Br

Isomeric SMILES

C1=CC(=CC(=C1)N)CNC(=O)C2=CC(=C(C=C2)C(=O)O)Br

InChI

InChI=1S/C15H13BrN2O3/c16-13-7-10(4-5-12(13)15(20)21)14(19)18-8-9-2-1-3-11(17)6-9/h1-7H,8,17H2,(H,18,19)(H,20,21)