(2S)-5-azanyl-2-[(4-nitrophenyl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-5-azanyl-2-[(4-nitrophenyl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-5-amino-2-(4-nitroanilino)-5-oxo-pentanoic acid CAS Name: (2S)-5-amino-2-(4-nitroanilino)-5-oxopentanoic acid IUPAC Name: (2S)-5-amino-2-(4-nitroanilino)-5-oxopentanoic acid Traditional Name: (2S)-5-amino-5-keto-2-(4-nitroanilino)valeric acid Formula: C11H13N3O5 MolecularWeight: 267.23802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(CCC(=O)N)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1N[C@@H](CCC(=O)N)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H13N3O5/c12-10(15)6-5-9(11(16)17)13-7-1-3-8(4-2-7)14(18)19/h1-4,9,13H,5-6H2,(H2,12,15)(H,16,17)/t9-/m0/s1