N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-N-(phenylmethyl)aniline phosphate

Systemtic Name: N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-N-(phenylmethyl)aniline phosphate Openeye Name: N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline phosphate CAS Name: N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-N-(phenylmethyl)aniline phosphate IUPAC Name: N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline phosphate Traditional Name: benzyl-(2-imidazolin-2-ylmethyl)-phenyl-amine phosphate Formula: C17H19N3O4P-3 MolecularWeight: 360.324221

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N1)CN(CC2=CC=CC=C2)C3=CC=CC=C3.[O-]P(=O)([O-])[O-]

Isomeric SMILES

C1CN=C(N1)CN(CC2=CC=CC=C2)C3=CC=CC=C3.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C17H19N3.H3O4P/c1-3-7-15(8-4-1)13-20(14-17-18-11-12-19-17)16-9-5-2-6-10-16;1-5(2,3)4/h1-10H,11-14H2,(H,18,19);(H3,1,2,3,4)/p-3