(E)-N-[(2S)-3-methyl-2-[nitroso(oxidanyl)amino]butyl]but-2-enamide

Systemtic Name: (E)-N-[(2S)-3-methyl-2-[nitroso(oxidanyl)amino]butyl]but-2-enamide Openeye Name: (E)-N-[(2S)-2-[hydroxy(nitroso)amino]-3-methyl-butyl]but-2-enamide CAS Name: (E)-N-[(2S)-2-[hydroxy(nitroso)amino]-3-methylbutyl]-2-butenamide IUPAC Name: (E)-N-[(2S)-2-[hydroxy(nitroso)amino]-3-methylbutyl]but-2-enamide Traditional Name: (E)-N-[(2S)-2-[hydroxy(nitroso)amino]-3-methyl-butyl]but-2-enamide Formula: C9H17N3O3 MolecularWeight: 215.24958

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)NCC(C(C)C)N(N=O)O

Isomeric SMILES

C/C=C/C(=O)NC[C@H](C(C)C)N(N=O)O

InChI

InChI=1S/C9H17N3O3/c1-4-5-9(13)10-6-8(7(2)3)12(15)11-14/h4-5,7-8,15H,6H2,1-3H3,(H,10,13)/b5-4+/t8-/m1/s1