[N-[4-(1H-imidazol-5-yl)phenyl]-N'-propan-2-yl-carbamimidoyl]phosphonic acid

Systemtic Name: [N-[4-(1H-imidazol-5-yl)phenyl]-N'-propan-2-yl-carbamimidoyl]phosphonic acid Openeye Name: [N-[4-(1H-imidazol-5-yl)phenyl]-N'-isopropyl-carbamimidoyl]phosphonic acid CAS Name: [[4-(1H-imidazol-5-yl)anilino]-propan-2-yliminomethyl]phosphonic acid IUPAC Name: [N-[4-(1H-imidazol-5-yl)phenyl]-N'-propan-2-ylcarbamimidoyl]phosphonic acid Traditional Name: [N-[4-(1H-imidazol-5-yl)phenyl]-N'-isopropyl-amidino]phosphonic acid Formula: C13H17N4O3P MolecularWeight: 308.272841

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N=C(NC1=CC=C(C=C1)C2=CN=CN2)P(=O)(O)O

Isomeric SMILES

CC(C)N=C(NC1=CC=C(C=C1)C2=CN=CN2)P(=O)(O)O

InChI

InChI=1S/C13H17N4O3P/c1-9(2)16-13(21(18,19)20)17-11-5-3-10(4-6-11)12-7-14-8-15-12/h3-9H,1-2H3,(H,14,15)(H,16,17)(H2,18,19,20)