[2-(3-methylbut-2-enoylamino)-3-(1,2,4-triazol-1-yl)propyl]phosphonic acid

Systemtic Name: [2-(3-methylbut-2-enoylamino)-3-(1,2,4-triazol-1-yl)propyl]phosphonic acid Openeye Name: [2-(3-methylbut-2-enoylamino)-3-(1,2,4-triazol-1-yl)propyl]phosphonic acid CAS Name: [2-[(3-methyl-1-oxobut-2-enyl)amino]-3-(1,2,4-triazol-1-yl)propyl]phosphonic acid IUPAC Name: [2-(3-methylbut-2-enoylamino)-3-(1,2,4-triazol-1-yl)propyl]phosphonic acid Traditional Name: [2-(3-methylbut-2-enoylamino)-3-(1,2,4-triazol-1-yl)propyl]phosphonic acid Formula: C10H17N4O4P MolecularWeight: 288.240141

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC(CN1C=NC=N1)CP(=O)(O)O)C

Isomeric SMILES

CC(=CC(=O)NC(CN1C=NC=N1)CP(=O)(O)O)C

InChI

InChI=1S/C10H17N4O4P/c1-8(2)3-10(15)13-9(5-19(16,17)18)4-14-7-11-6-12-14/h3,6-7,9H,4-5H2,1-2H3,(H,13,15)(H2,16,17,18)