phenyl-[[(phenylmethyl)amino]-[3-(phenylmethyl)imidazol-4-yl]methyl]phosphinic acid

Systemtic Name: phenyl-[[(phenylmethyl)amino]-[3-(phenylmethyl)imidazol-4-yl]methyl]phosphinic acid Openeye Name: [(benzylamino)-(3-benzylimidazol-4-yl)methyl]-phenyl-phosphinic acid CAS Name: phenyl-[[(phenylmethyl)amino]-[3-(phenylmethyl)-4-imidazolyl]methyl]phosphinic acid IUPAC Name: [(benzylamino)-(3-benzylimidazol-4-yl)methyl]-phenylphosphinic acid Traditional Name: [(benzylamino)-(3-benzylimidazol-4-yl)methyl]-phenyl-phosphinic acid Formula: C24H24N3O2P MolecularWeight: 417.440021

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(C2=CN=CN2CC3=CC=CC=C3)P(=O)(C4=CC=CC=C4)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(C2=CN=CN2CC3=CC=CC=C3)P(=O)(C4=CC=CC=C4)O

InChI

InChI=1S/C24H24N3O2P/c28-30(29,22-14-8-3-9-15-22)24(26-16-20-10-4-1-5-11-20)23-17-25-19-27(23)18-21-12-6-2-7-13-21/h1-15,17,19,24,26H,16,18H2,(H,28,29)