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

Systemtic Name: [2-benzamido-3-(1,2,4-triazol-1-yl)propyl]phosphonic acid Openeye Name: [2-benzamido-3-(1,2,4-triazol-1-yl)propyl]phosphonic acid CAS Name: [2-benzamido-3-(1,2,4-triazol-1-yl)propyl]phosphonic acid IUPAC Name: [2-benzamido-3-(1,2,4-triazol-1-yl)propyl]phosphonic acid Traditional Name: [2-benzamido-3-(1,2,4-triazol-1-yl)propyl]phosphonic acid Formula: C12H15N4O4P MolecularWeight: 310.245661

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(CN2C=NC=N2)CP(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(CN2C=NC=N2)CP(=O)(O)O

InChI

InChI=1S/C12H15N4O4P/c17-12(10-4-2-1-3-5-10)15-11(7-21(18,19)20)6-16-9-13-8-14-16/h1-5,8-9,11H,6-7H2,(H,15,17)(H2,18,19,20)