(3R)-3-(methylazaniumyl)-4-[(3-nitrophenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: (3R)-3-(methylazaniumyl)-4-[(3-nitrophenyl)amino]-4-oxidanylidene-butanoate Openeye Name: (3R)-3-(methylammonio)-4-(3-nitroanilino)-4-oxo-butanoate CAS Name: (3R)-3-(methylammonio)-4-(3-nitroanilino)-4-oxobutanoate IUPAC Name: (3R)-3-(methylazaniumyl)-4-(3-nitroanilino)-4-oxobutanoate Traditional Name: (3R)-4-keto-3-(methylammonio)-4-(3-nitroanilino)butyrate Formula: C11H13N3O5 MolecularWeight: 267.23802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O5/c1-12-9(6-10(15)16)11(17)13-7-3-2-4-8(5-7)14(18)19/h2-5,9,12H,6H2,1H3,(H,13,17)(H,15,16)/t9-/m1/s1