6-(3-imidazol-1-ylpropylamino)-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-(3-imidazol-1-ylpropylamino)-6-oxidanylidene-hexanoic acid Openeye Name: 6-(3-imidazol-1-ylpropylamino)-6-oxo-hexanoic acid CAS Name: 6-[3-(1-imidazolyl)propylamino]-6-oxohexanoic acid IUPAC Name: 6-(3-imidazol-1-ylpropylamino)-6-oxohexanoic acid Traditional Name: 6-(3-imidazol-1-ylpropylamino)-6-keto-hexanoic acid Formula: C12H19N3O3 MolecularWeight: 253.29756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)CCCNC(=O)CCCCC(=O)O

Isomeric SMILES

C1=CN(C=N1)CCCNC(=O)CCCCC(=O)O

InChI

InChI=1S/C12H19N3O3/c16-11(4-1-2-5-12(17)18)14-6-3-8-15-9-7-13-10-15/h7,9-10H,1-6,8H2,(H,14,16)(H,17,18)