[N'-cyclohexyl-N-[3-(1H-imidazol-5-yl)phenyl]carbamimidoyl]phosphonic acid

Systemtic Name: [N'-cyclohexyl-N-[3-(1H-imidazol-5-yl)phenyl]carbamimidoyl]phosphonic acid Openeye Name: [N'-cyclohexyl-N-[3-(1H-imidazol-5-yl)phenyl]carbamimidoyl]phosphonic acid CAS Name: [cyclohexylimino-[3-(1H-imidazol-5-yl)anilino]methyl]phosphonic acid IUPAC Name: [N'-cyclohexyl-N-[3-(1H-imidazol-5-yl)phenyl]carbamimidoyl]phosphonic acid Traditional Name: [N'-cyclohexyl-N-[3-(1H-imidazol-5-yl)phenyl]amidino]phosphonic acid Formula: C16H21N4O3P MolecularWeight: 348.336701

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N=C(NC2=CC=CC(=C2)C3=CN=CN3)P(=O)(O)O

Isomeric SMILES

C1CCC(CC1)N=C(NC2=CC=CC(=C2)C3=CN=CN3)P(=O)(O)O

InChI

InChI=1S/C16H21N4O3P/c21-24(22,23)16(19-13-6-2-1-3-7-13)20-14-8-4-5-12(9-14)15-10-17-11-18-15/h4-5,8-11,13H,1-3,6-7H2,(H,17,18)(H,19,20)(H2,21,22,23)