(2S)-2-acetamido-3-(1-nitrosoindol-3-yl)propanoic acid

Systemtic Name: (2S)-2-acetamido-3-(1-nitrosoindol-3-yl)propanoic acid Openeye Name: (2S)-2-acetamido-3-(1-nitrosoindol-3-yl)propanoic acid CAS Name: (2S)-2-acetamido-3-(1-nitroso-3-indolyl)propanoic acid IUPAC Name: (2S)-2-acetamido-3-(1-nitrosoindol-3-yl)propanoic acid Traditional Name: (2S)-2-acetamido-3-(1-nitrosoindol-3-yl)propionic acid Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CN(C2=CC=CC=C21)N=O)C(=O)O

Isomeric SMILES

CC(=O)N[C@@H](CC1=CN(C2=CC=CC=C21)N=O)C(=O)O

InChI

InChI=1S/C13H13N3O4/c1-8(17)14-11(13(18)19)6-9-7-16(15-20)12-5-3-2-4-10(9)12/h2-5,7,11H,6H2,1H3,(H,14,17)(H,18,19)/t11-/m0/s1