(2R)-4-[(4-ethylphenyl)amino]-2-[2-(2-hydroxyethyloxy)ethylazaniumyl]-4-oxidanylidene-butanoate

Systemtic Name: (2R)-4-[(4-ethylphenyl)amino]-2-[2-(2-hydroxyethyloxy)ethylazaniumyl]-4-oxidanylidene-butanoate Openeye Name: (2R)-4-(4-ethylanilino)-2-[2-(2-hydroxyethoxy)ethylammonio]-4-oxo-butanoate CAS Name: (2R)-4-(4-ethylanilino)-2-[2-(2-hydroxyethoxy)ethylammonio]-4-oxobutanoate IUPAC Name: (2R)-4-(4-ethylanilino)-2-[2-(2-hydroxyethoxy)ethylazaniumyl]-4-oxobutanoate Traditional Name: (2R)-4-(4-ethylanilino)-2-[2-(2-hydroxyethoxy)ethylammonio]-4-keto-butyrate Formula: C16H24N2O5 MolecularWeight: 324.37216

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CC(C(=O)[O-])[NH2+]CCOCCO

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C[C@H](C(=O)[O-])[NH2+]CCOCCO

InChI

InChI=1S/C16H24N2O5/c1-2-12-3-5-13(6-4-12)18-15(20)11-14(16(21)22)17-7-9-23-10-8-19/h3-6,14,17,19H,2,7-11H2,1H3,(H,18,20)(H,21,22)/t14-/m1/s1