2-azanyl-2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]-2-phenyl-ethanoic acid

Systemtic Name: 2-azanyl-2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]-2-phenyl-ethanoic acid Openeye Name: 2-amino-2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]-2-phenyl-acetic acid CAS Name: 2-amino-2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]-2-phenylacetic acid IUPAC Name: 2-amino-2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]-2-phenylacetic acid Traditional Name: 2-amino-2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]-2-phenyl-acetic acid Formula: C16H21N3O8 MolecularWeight: 383.35324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O8/c17-16(15(26)27,11-4-2-1-3-5-11)19(10-14(24)25)7-6-18(8-12(20)21)9-13(22)23/h1-5H,6-10,17H2,(H,20,21)(H,22,23)(H,24,25)(H,26,27)