sodium; N,N-dimethylmethanamide; (3-nitrophenyl) [4-(phenylmethyl)phenyl] phosphate

Systemtic Name: sodium; N,N-dimethylmethanamide; (3-nitrophenyl) [4-(phenylmethyl)phenyl] phosphate Openeye Name: sodium; (4-benzylphenyl) (3-nitrophenyl) phosphate; N,N-dimethylformamide CAS Name: sodium; N,N-dimethylformamide; (3-nitrophenyl) [4-(phenylmethyl)phenyl] phosphate IUPAC Name: sodium; (4-benzylphenyl) (3-nitrophenyl) phosphate; N,N-dimethylformamide Traditional Name: sodium; (4-benzylphenyl) (3-nitrophenyl) phosphate; N,N-dimethylformamide Formula: C22H22N2NaO7P MolecularWeight: 480.382811

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=O.C1=CC=C(C=C1)CC2=CC=C(C=C2)OP(=O)([O-])OC3=CC=CC(=C3)[N+](=O)[O-].[Na+]

Isomeric SMILES

CN(C)C=O.C1=CC=C(C=C1)CC2=CC=C(C=C2)OP(=O)([O-])OC3=CC=CC(=C3)[N+](=O)[O-].[Na+]

InChI

InChI=1S/C19H16NO6P.C3H7NO.Na/c21-20(22)17-7-4-8-19(14-17)26-27(23,24)25-18-11-9-16(10-12-18)13-15-5-2-1-3-6-15;1-4(2)3-5;/h1-12,14H,13H2,(H,23,24);3H,1-2H3;/q;;+1/p-1