2-[2-azanylethyl(carboxymethyl)amino]ethanoic acid; 2-(phenylmethoxymethyl)butanedioic acid

Systemtic Name: 2-[2-azanylethyl(carboxymethyl)amino]ethanoic acid; 2-(phenylmethoxymethyl)butanedioic acid Openeye Name: 2-[2-aminoethyl(carboxymethyl)amino]acetic acid; 2-(benzyloxymethyl)butanedioic acid CAS Name: 2-[2-aminoethyl(carboxymethyl)amino]acetic acid; 2-(phenylmethoxymethyl)butanedioic acid IUPAC Name: 2-[2-aminoethyl(carboxymethyl)amino]acetic acid; 2-(phenylmethoxymethyl)butanedioic acid Traditional Name: 2-[2-aminoethyl(carboxymethyl)amino]acetic acid; 2-(benzoxymethyl)succinic acid Formula: C18H26N2O9 MolecularWeight: 414.40704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC(CC(=O)O)C(=O)O.C(CN(CC(=O)O)CC(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)COCC(CC(=O)O)C(=O)O.C(CN(CC(=O)O)CC(=O)O)N

InChI

InChI=1S/C12H14O5.C6H12N2O4/c13-11(14)6-10(12(15)16)8-17-7-9-4-2-1-3-5-9;7-1-2-8(3-5(9)10)4-6(11)12/h1-5,10H,6-8H2,(H,13,14)(H,15,16);1-4,7H2,(H,9,10)(H,11,12)