(2R)-2-[2-(diethylazaniumyl)ethylazaniumyl]-4-[(2-nitrophenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: (2R)-2-[2-(diethylazaniumyl)ethylazaniumyl]-4-[(2-nitrophenyl)amino]-4-oxidanylidene-butanoate Openeye Name: (2R)-2-[2-(diethylammonio)ethylammonio]-4-(2-nitroanilino)-4-oxo-butanoate CAS Name: (2R)-2-[2-(diethylammonio)ethylammonio]-4-(2-nitroanilino)-4-oxobutanoate IUPAC Name: (2R)-2-[2-(diethylazaniumyl)ethylazaniumyl]-4-(2-nitroanilino)-4-oxobutanoate Traditional Name: (2R)-2-[2-(diethylammonio)ethylammonio]-4-keto-4-(2-nitroanilino)butyrate Formula: C16H25N4O5+ MolecularWeight: 353.3935

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC[NH2+]C(CC(=O)NC1=CC=CC=C1[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CC[NH+](CC)CC[NH2+][C@H](CC(=O)NC1=CC=CC=C1[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C16H24N4O5/c1-3-19(4-2)10-9-17-13(16(22)23)11-15(21)18-12-7-5-6-8-14(12)20(24)25/h5-8,13,17H,3-4,9-11H2,1-2H3,(H,18,21)(H,22,23)/p+1/t13-/m1/s1