2-ethyl-2-[[(3-oxidanidyl-3-oxidanylidene-propyl)-phenethyl-amino]methyl]butanoate

Systemtic Name: 2-ethyl-2-[[(3-oxidanidyl-3-oxidanylidene-propyl)-phenethyl-amino]methyl]butanoate Openeye Name: 2-ethyl-2-[[(3-oxido-3-oxo-propyl)-phenethyl-amino]methyl]butanoate CAS Name: 2-ethyl-2-[[(3-oxido-3-oxopropyl)-phenethylamino]methyl]butanoate IUPAC Name: 2-ethyl-2-[[(3-oxido-3-oxopropyl)-phenethylamino]methyl]butanoate Traditional Name: 2-ethyl-2-[[(3-keto-3-oxido-propyl)-phenethyl-amino]methyl]butyrate Formula: C18H25NO4-2 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CN(CCC1=CC=CC=C1)CCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCC(CC)(CN(CCC1=CC=CC=C1)CCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C18H27NO4/c1-3-18(4-2,17(22)23)14-19(13-11-16(20)21)12-10-15-8-6-5-7-9-15/h5-9H,3-4,10-14H2,1-2H3,(H,20,21)(H,22,23)/p-2