(2R)-2-acetamido-3-(6-nitro-1H-indol-3-yl)propanoic acid

Systemtic Name: (2R)-2-acetamido-3-(6-nitro-1H-indol-3-yl)propanoic acid Openeye Name: (2R)-2-acetamido-3-(6-nitro-1H-indol-3-yl)propanoic acid CAS Name: (2R)-2-acetamido-3-(6-nitro-1H-indol-3-yl)propanoic acid IUPAC Name: (2R)-2-acetamido-3-(6-nitro-1H-indol-3-yl)propanoic acid Traditional Name: (2R)-2-acetamido-3-(6-nitro-1H-indol-3-yl)propionic acid Formula: C13H13N3O5 MolecularWeight: 291.25942

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CNC2=C1C=CC(=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(=O)N[C@H](CC1=CNC2=C1C=CC(=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C13H13N3O5/c1-7(17)15-12(13(18)19)4-8-6-14-11-5-9(16(20)21)2-3-10(8)11/h2-3,5-6,12,14H,4H2,1H3,(H,15,17)(H,18,19)/t12-/m1/s1