2-azanyl-5-(4-azanyl-3-carboxy-5-methyl-phenyl)-3-methyl-benzoic acid

Systemtic Name: 2-azanyl-5-(4-azanyl-3-carboxy-5-methyl-phenyl)-3-methyl-benzoic acid Openeye Name: 2-amino-5-(4-amino-3-carboxy-5-methyl-phenyl)-3-methyl-benzoic acid CAS Name: 2-amino-5-(4-amino-3-carboxy-5-methylphenyl)-3-methylbenzoic acid IUPAC Name: 2-amino-5-(4-amino-3-carboxy-5-methylphenyl)-3-methylbenzoic acid Traditional Name: 2-amino-5-(4-amino-3-carboxy-5-methyl-phenyl)-3-methyl-benzoic acid Formula: C16H16N2O4 MolecularWeight: 300.30924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1N)C(=O)O)C2=CC(=C(C(=C2)C)N)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1N)C(=O)O)C2=CC(=C(C(=C2)C)N)C(=O)O

InChI

InChI=1S/C16H16N2O4/c1-7-3-9(5-11(13(7)17)15(19)20)10-4-8(2)14(18)12(6-10)16(21)22/h3-6H,17-18H2,1-2H3,(H,19,20)(H,21,22)