(2R)-4-[(3-chlorophenyl)amino]-2-[2-(2-hydroxyethyloxy)ethylazaniumyl]-4-oxidanylidene-butanoate

Systemtic Name: (2R)-4-[(3-chlorophenyl)amino]-2-[2-(2-hydroxyethyloxy)ethylazaniumyl]-4-oxidanylidene-butanoate Openeye Name: (2R)-4-(3-chloroanilino)-2-[2-(2-hydroxyethoxy)ethylammonio]-4-oxo-butanoate CAS Name: (2R)-4-(3-chloroanilino)-2-[2-(2-hydroxyethoxy)ethylammonio]-4-oxobutanoate IUPAC Name: (2R)-4-(3-chloroanilino)-2-[2-(2-hydroxyethoxy)ethylazaniumyl]-4-oxobutanoate Traditional Name: (2R)-4-(3-chloroanilino)-2-[2-(2-hydroxyethoxy)ethylammonio]-4-keto-butyrate Formula: C14H19ClN2O5 MolecularWeight: 330.76406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19ClN2O5/c15-10-2-1-3-11(8-10)17-13(19)9-12(14(20)21)16-4-6-22-7-5-18/h1-3,8,12,16,18H,4-7,9H2,(H,17,19)(H,20,21)/t12-/m1/s1