(2S,3S)-2-azanyl-3-methyl-pentanoic acid; pyrrol-2-ylidenemethylideneazanide

Systemtic Name: (2S,3S)-2-azanyl-3-methyl-pentanoic acid; pyrrol-2-ylidenemethylideneazanide Openeye Name: (2S,3S)-2-amino-3-methyl-pentanoic acid; pyrrol-2-ylidenemethyleneazanide CAS Name: (2S,3S)-2-amino-3-methylpentanoic acid; 2-pyrrolylidenemethylideneazanide IUPAC Name: (2S,3S)-2-amino-3-methylpentanoic acid; pyrrol-2-ylidenemethylideneazanide Traditional Name: (2S,3S)-2-amino-3-methyl-valeric acid; pyrrol-2-ylidenemethyleneazanide Formula: C11H16N3O2- MolecularWeight: 222.26364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)O)N.C1=CC(=C=[N-])N=C1

InChI

InChI=1S/C6H13NO2.C5H3N2/c1-3-4(2)5(7)6(8)9;6-4-5-2-1-3-7-5/h4-5H,3,7H2,1-2H3,(H,8,9);1-3H/q;-1/t4-,5-;/m0./s1