5-[[2-[bis(carboxymethyl)carbamoyl]phenyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[2-[bis(carboxymethyl)carbamoyl]phenyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[2-[bis(carboxymethyl)carbamoyl]anilino]-5-oxo-pentanoic acid CAS Name: 5-[2-[[bis(carboxymethyl)amino]-oxomethyl]anilino]-5-oxopentanoic acid IUPAC Name: 5-[2-[bis(carboxymethyl)carbamoyl]anilino]-5-oxopentanoic acid Traditional Name: 5-[2-[bis(carboxymethyl)carbamoyl]anilino]-5-keto-valeric acid Formula: C16H18N2O8 MolecularWeight: 366.32272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)N(CC(=O)O)CC(=O)O)NC(=O)CCCC(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N(CC(=O)O)CC(=O)O)NC(=O)CCCC(=O)O

InChI

InChI=1S/C16H18N2O8/c19-12(6-3-7-13(20)21)17-11-5-2-1-4-10(11)16(26)18(8-14(22)23)9-15(24)25/h1-2,4-5H,3,6-9H2,(H,17,19)(H,20,21)(H,22,23)(H,24,25)