2-[(4-azanyl-3-methyl-phenyl)amino]pentanedioate

Systemtic Name: 2-[(4-azanyl-3-methyl-phenyl)amino]pentanedioate Openeye Name: 2-(4-amino-3-methyl-anilino)pentanedioate CAS Name: 2-(4-amino-3-methylanilino)pentanedioate IUPAC Name: 2-(4-amino-3-methylanilino)pentanedioate Traditional Name: 2-(4-amino-3-methyl-anilino)glutarate Formula: C12H14N2O4-2 MolecularWeight: 250.25056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(CCC(=O)[O-])C(=O)[O-])N

Isomeric SMILES

CC1=C(C=CC(=C1)NC(CCC(=O)[O-])C(=O)[O-])N

InChI

InChI=1S/C12H16N2O4/c1-7-6-8(2-3-9(7)13)14-10(12(17)18)4-5-11(15)16/h2-3,6,10,14H,4-5,13H2,1H3,(H,15,16)(H,17,18)/p-2