2-[[2-azanyl-1-(4-hexoxyphenyl)-2-oxidanylidene-ethyl]-(carboxymethyl)amino]ethanoic acid

Systemtic Name: 2-[[2-azanyl-1-(4-hexoxyphenyl)-2-oxidanylidene-ethyl]-(carboxymethyl)amino]ethanoic acid Openeye Name: 2-[[2-amino-1-(4-hexoxyphenyl)-2-oxo-ethyl]-(carboxymethyl)amino]acetic acid CAS Name: 2-[[2-amino-1-(4-hexoxyphenyl)-2-oxoethyl]-(carboxymethyl)amino]acetic acid IUPAC Name: 2-[[2-amino-1-(4-hexoxyphenyl)-2-oxoethyl]-(carboxymethyl)amino]acetic acid Traditional Name: 2-[[2-amino-1-(4-hexoxyphenyl)-2-keto-ethyl]-(carboxymethyl)amino]acetic acid Formula: C18H26N2O6 MolecularWeight: 366.40884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(C(=O)N)N(CC(=O)O)CC(=O)O

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(C(=O)N)N(CC(=O)O)CC(=O)O

InChI

InChI=1S/C18H26N2O6/c1-2-3-4-5-10-26-14-8-6-13(7-9-14)17(18(19)25)20(11-15(21)22)12-16(23)24/h6-9,17H,2-5,10-12H2,1H3,(H2,19,25)(H,21,22)(H,23,24)