[(4-nitrophenyl)-[(phenylmethyl)amino]methyl]phosphonic acid

Systemtic Name: [(4-nitrophenyl)-[(phenylmethyl)amino]methyl]phosphonic acid Openeye Name: [(benzylamino)-(4-nitrophenyl)methyl]phosphonic acid CAS Name: [(4-nitrophenyl)-[(phenylmethyl)amino]methyl]phosphonic acid IUPAC Name: [(benzylamino)-(4-nitrophenyl)methyl]phosphonic acid Traditional Name: [(benzylamino)-(4-nitrophenyl)methyl]phosphonic acid Formula: C14H15N2O5P MolecularWeight: 322.253061

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(C2=CC=C(C=C2)[N+](=O)[O-])P(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(C2=CC=C(C=C2)[N+](=O)[O-])P(=O)(O)O

InChI

InChI=1S/C14H15N2O5P/c17-16(18)13-8-6-12(7-9-13)14(22(19,20)21)15-10-11-4-2-1-3-5-11/h1-9,14-15H,10H2,(H2,19,20,21)