5-bromanyl-2-[(2,4-dimethoxyphenyl)methylamino]benzoic acid

Systemtic Name: 5-bromanyl-2-[(2,4-dimethoxyphenyl)methylamino]benzoic acid Openeye Name: 5-bromo-2-[(2,4-dimethoxyphenyl)methylamino]benzoic acid CAS Name: 5-bromo-2-[(2,4-dimethoxyphenyl)methylamino]benzoic acid IUPAC Name: 5-bromo-2-[(2,4-dimethoxyphenyl)methylamino]benzoic acid Traditional Name: 5-bromo-2-[(2,4-dimethoxybenzyl)amino]benzoic acid Formula: C16H16BrNO4 MolecularWeight: 366.20654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC2=C(C=C(C=C2)Br)C(=O)O)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC2=C(C=C(C=C2)Br)C(=O)O)OC

InChI

InChI=1S/C16H16BrNO4/c1-21-12-5-3-10(15(8-12)22-2)9-18-14-6-4-11(17)7-13(14)16(19)20/h3-8,18H,9H2,1-2H3,(H,19,20)