2-azanyl-4-[2-(3-azanyl-4-carboxy-phenyl)propan-2-yl]benzoic acid

Systemtic Name: 2-azanyl-4-[2-(3-azanyl-4-carboxy-phenyl)propan-2-yl]benzoic acid Openeye Name: 2-amino-4-[1-(3-amino-4-carboxy-phenyl)-1-methyl-ethyl]benzoic acid CAS Name: 2-amino-4-[2-(3-amino-4-carboxyphenyl)propan-2-yl]benzoic acid IUPAC Name: 2-amino-4-[2-(3-amino-4-carboxyphenyl)propan-2-yl]benzoic acid Traditional Name: 2-amino-4-[1-(3-amino-4-carboxy-phenyl)-1-methyl-ethyl]benzoic acid Formula: C17H18N2O4 MolecularWeight: 314.33582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O4/c1-17(2,9-3-5-11(15(20)21)13(18)7-9)10-4-6-12(16(22)23)14(19)8-10/h3-8H,18-19H2,1-2H3,(H,20,21)(H,22,23)