sodium [4-[3-[2-(dimethylaminomethyl)phenyl]propanoyl]phenyl] phenyl phosphate

Systemtic Name: sodium [4-[3-[2-(dimethylaminomethyl)phenyl]propanoyl]phenyl] phenyl phosphate Openeye Name: sodium [4-[3-[2-(dimethylaminomethyl)phenyl]propanoyl]phenyl] phenyl phosphate CAS Name: sodium [4-[3-[2-(dimethylaminomethyl)phenyl]-1-oxopropyl]phenyl] phenyl phosphate IUPAC Name: sodium [4-[3-[2-(dimethylaminomethyl)phenyl]propanoyl]phenyl] phenyl phosphate Traditional Name: sodium [4-[3-[2-(dimethylaminomethyl)phenyl]propanoyl]phenyl] phenyl phosphate Formula: C24H25NNaO5P MolecularWeight: 461.422531

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1CCC(=O)C2=CC=C(C=C2)OP(=O)([O-])OC3=CC=CC=C3.[Na+]

Isomeric SMILES

CN(C)CC1=CC=CC=C1CCC(=O)C2=CC=C(C=C2)OP(=O)([O-])OC3=CC=CC=C3.[Na+]

InChI

InChI=1S/C24H26NO5P.Na/c1-25(2)18-21-9-7-6-8-19(21)14-17-24(26)20-12-15-23(16-13-20)30-31(27,28)29-22-10-4-3-5-11-22;/h3-13,15-16H,14,17-18H2,1-2H3,(H,27,28);/q;+1/p-1