(2S)-2-azanyl-3-(1H-imidazol-5-yl)-N-(4-nitrophenyl)propanamide

Systemtic Name: (2S)-2-azanyl-3-(1H-imidazol-5-yl)-N-(4-nitrophenyl)propanamide Openeye Name: (2S)-2-amino-3-(1H-imidazol-5-yl)-N-(4-nitrophenyl)propanamide CAS Name: (2S)-2-amino-3-(1H-imidazol-5-yl)-N-(4-nitrophenyl)propanamide IUPAC Name: (2S)-2-amino-3-(1H-imidazol-5-yl)-N-(4-nitrophenyl)propanamide Traditional Name: (2S)-2-amino-3-(1H-imidazol-5-yl)-N-(4-nitrophenyl)propionamide Formula: C12H13N5O3 MolecularWeight: 275.26332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C(CC2=CN=CN2)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)[C@H](CC2=CN=CN2)N)[N+](=O)[O-]

InChI

InChI=1S/C12H13N5O3/c13-11(5-9-6-14-7-15-9)12(18)16-8-1-3-10(4-2-8)17(19)20/h1-4,6-7,11H,5,13H2,(H,14,15)(H,16,18)/t11-/m0/s1