[[(E)-5-azanyl-2-(2-azanylethanoyl)-4-oxidanylidene-pent-2-enoyl]amino]-ethyl-azanium iodide

Systemtic Name: [[(E)-5-azanyl-2-(2-azanylethanoyl)-4-oxidanylidene-pent-2-enoyl]amino]-ethyl-azanium iodide Openeye Name: [[(E)-5-amino-2-(2-aminoacetyl)-4-oxo-pent-2-enoyl]amino]-ethyl-ammonium iodide CAS Name: [[(E)-5-amino-2-(2-amino-1-oxoethyl)-1,4-dioxopent-2-enyl]amino]-ethylammonium iodide IUPAC Name: [[(E)-5-amino-2-(2-aminoacetyl)-4-oxopent-2-enoyl]amino]-ethylazanium iodide Traditional Name: [[(E)-5-amino-2-glycyl-4-keto-pent-2-enoyl]amino]-ethyl-ammonium iodide Formula: C9H17IN4O3 MolecularWeight: 356.16075

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]NC(=O)C(=CC(=O)CN)C(=O)CN.[I-]

Isomeric SMILES

CC[NH2+]NC(=O)/C(=C/C(=O)CN)/C(=O)CN.[I-]

InChI

InChI=1S/C9H16N4O3.HI/c1-2-12-13-9(16)7(8(15)5-11)3-6(14)4-10;/h3,12H,2,4-5,10-11H2,1H3,(H,13,16);1H/b7-3+;