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

Systemtic Name: (2R)-2-[2-(2-hydroxyethyloxy)ethylazaniumyl]-4-[(4-methoxyphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: (2R)-2-[2-(2-hydroxyethoxy)ethylammonio]-4-(4-methoxyanilino)-4-oxo-butanoate CAS Name: (2R)-2-[2-(2-hydroxyethoxy)ethylammonio]-4-(4-methoxyanilino)-4-oxobutanoate IUPAC Name: (2R)-2-[2-(2-hydroxyethoxy)ethylazaniumyl]-4-(4-methoxyanilino)-4-oxobutanoate Traditional Name: (2R)-2-[2-(2-hydroxyethoxy)ethylammonio]-4-keto-4-(p-anisidino)butyrate Formula: C15H22N2O6 MolecularWeight: 326.34498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CC(C(=O)[O-])[NH2+]CCOCCO

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C[C@H](C(=O)[O-])[NH2+]CCOCCO

InChI

InChI=1S/C15H22N2O6/c1-22-12-4-2-11(3-5-12)17-14(19)10-13(15(20)21)16-6-8-23-9-7-18/h2-5,13,16,18H,6-10H2,1H3,(H,17,19)(H,20,21)/t13-/m1/s1