2-[[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl]-(carboxymethyl)amino]ethanoic acid

Systemtic Name: 2-[[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl]-(carboxymethyl)amino]ethanoic acid Openeye Name: 2-[[2-(4-butylanilino)-2-oxo-ethyl]-(carboxymethyl)amino]acetic acid CAS Name: 2-[[2-(4-butylanilino)-2-oxoethyl]-(carboxymethyl)amino]acetic acid IUPAC Name: 2-[[2-(4-butylanilino)-2-oxoethyl]-(carboxymethyl)amino]acetic acid Traditional Name: 2-[[2-(4-butylanilino)-2-keto-ethyl]-(carboxymethyl)amino]acetic acid Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CN(CC(=O)O)CC(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CN(CC(=O)O)CC(=O)O

InChI

InChI=1S/C16H22N2O5/c1-2-3-4-12-5-7-13(8-6-12)17-14(19)9-18(10-15(20)21)11-16(22)23/h5-8H,2-4,9-11H2,1H3,(H,17,19)(H,20,21)(H,22,23)