2,6-bis(azanyl)-2-[(3-chloranyl-2-methyl-phenyl)amino]hexanoic acid

Systemtic Name: 2,6-bis(azanyl)-2-[(3-chloranyl-2-methyl-phenyl)amino]hexanoic acid Openeye Name: 2,6-diamino-2-(3-chloro-2-methyl-anilino)hexanoic acid CAS Name: 2,6-diamino-2-(3-chloro-2-methylanilino)hexanoic acid IUPAC Name: 2,6-diamino-2-(3-chloro-2-methylanilino)hexanoic acid Traditional Name: 2,6-diamino-2-(3-chloro-2-methyl-anilino)hexanoic acid Formula: C13H20ClN3O2 MolecularWeight: 285.7698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(CCCCN)(C(=O)O)N

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(CCCCN)(C(=O)O)N

InChI

InChI=1S/C13H20ClN3O2/c1-9-10(14)5-4-6-11(9)17-13(16,12(18)19)7-2-3-8-15/h4-6,17H,2-3,7-8,15-16H2,1H3,(H,18,19)