sodium [4-[(E)-3-(3-nitrophenyl)-3-oxidanylidene-prop-1-enyl]phenyl] phenyl phosphate

Systemtic Name: sodium [4-[(E)-3-(3-nitrophenyl)-3-oxidanylidene-prop-1-enyl]phenyl] phenyl phosphate Openeye Name: sodium [4-[(E)-3-(3-nitrophenyl)-3-oxo-prop-1-enyl]phenyl] phenyl phosphate CAS Name: sodium [4-[(E)-3-(3-nitrophenyl)-3-oxoprop-1-enyl]phenyl] phenyl phosphate IUPAC Name: sodium [4-[(E)-3-(3-nitrophenyl)-3-oxoprop-1-enyl]phenyl] phenyl phosphate Traditional Name: sodium [4-[(E)-3-keto-3-(3-nitrophenyl)prop-1-enyl]phenyl] phenyl phosphate Formula: C21H15NNaO7P MolecularWeight: 447.309831

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OP(=O)([O-])OC2=CC=C(C=C2)C=CC(=O)C3=CC(=CC=C3)[N+](=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)OP(=O)([O-])OC2=CC=C(C=C2)/C=C/C(=O)C3=CC(=CC=C3)[N+](=O)[O-].[Na+]

InChI

InChI=1S/C21H16NO7P.Na/c23-21(17-5-4-6-18(15-17)22(24)25)14-11-16-9-12-20(13-10-16)29-30(26,27)28-19-7-2-1-3-8-19;/h1-15H,(H,26,27);/q;+1/p-1/b14-11+;