[3-[(4-methylphenyl)methylcarbamoyl]imidazolidin-4-yl]phosphonic acid

Systemtic Name: [3-[(4-methylphenyl)methylcarbamoyl]imidazolidin-4-yl]phosphonic acid Openeye Name: [3-(p-tolylmethylcarbamoyl)imidazolidin-4-yl]phosphonic acid CAS Name: [3-[[(4-methylphenyl)methylamino]-oxomethyl]-4-imidazolidinyl]phosphonic acid IUPAC Name: [3-[(4-methylphenyl)methylcarbamoyl]imidazolidin-4-yl]phosphonic acid Traditional Name: [3-[(4-methylbenzyl)carbamoyl]imidazolidin-4-yl]phosphonic acid Formula: C12H18N3O4P MolecularWeight: 299.262781

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)N2CNCC2P(=O)(O)O

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)N2CNCC2P(=O)(O)O

InChI

InChI=1S/C12H18N3O4P/c1-9-2-4-10(5-3-9)6-14-12(16)15-8-13-7-11(15)20(17,18)19/h2-5,11,13H,6-8H2,1H3,(H,14,16)(H2,17,18,19)