2-(4-aminophenyl)-2-azanyl-4,4-bis(carboxymethylamino)pentanoic acid tetrahydrochloride

Systemtic Name: 2-(4-aminophenyl)-2-azanyl-4,4-bis(carboxymethylamino)pentanoic acid tetrahydrochloride Openeye Name: 2-amino-2-(4-aminophenyl)-4,4-bis(carboxymethylamino)pentanoic acid tetrahydrochloride CAS Name: 2-amino-2-(4-aminophenyl)-4,4-bis(carboxymethylamino)pentanoic acid tetrahydrochloride IUPAC Name: 2-amino-2-(4-aminophenyl)-4,4-bis(carboxymethylamino)pentanoic acid tetrahydrochloride Traditional Name: 2-amino-2-(4-aminophenyl)-4,4-bis(carboxymethylamino)valeric acid tetrahydrochloride Formula: C15H26Cl4N4O6 MolecularWeight: 500.20214

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C1=CC=C(C=C1)N)(C(=O)O)N)(NCC(=O)O)NCC(=O)O.Cl.Cl.Cl.Cl

Isomeric SMILES

CC(CC(C1=CC=C(C=C1)N)(C(=O)O)N)(NCC(=O)O)NCC(=O)O.Cl.Cl.Cl.Cl

InChI

InChI=1S/C15H22N4O6.4ClH/c1-14(18-6-11(20)21,19-7-12(22)23)8-15(17,13(24)25)9-2-4-10(16)5-3-9;;;;/h2-5,18-19H,6-8,16-17H2,1H3,(H,20,21)(H,22,23)(H,24,25);4*1H