sodium 3-[3-[[(4-methoxyphenyl)carbonyl-phenyl-amino]methyl]phenyl]benzoate

Systemtic Name: sodium 3-[3-[[(4-methoxyphenyl)carbonyl-phenyl-amino]methyl]phenyl]benzoate Openeye Name: sodium 3-[3-[(N-(4-methoxybenzoyl)anilino)methyl]phenyl]benzoate CAS Name: sodium 3-[3-[(N-[(4-methoxyphenyl)-oxomethyl]anilino)methyl]phenyl]benzoate IUPAC Name: sodium 3-[3-[(N-(4-methoxybenzoyl)anilino)methyl]phenyl]benzoate Traditional Name: sodium 3-[3-[(N-p-anisoylanilino)methyl]phenyl]benzoate Formula: C28H22NNaO4 MolecularWeight: 459.46835

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N(CC2=CC=CC(=C2)C3=CC(=CC=C3)C(=O)[O-])C4=CC=CC=C4.[Na+]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N(CC2=CC=CC(=C2)C3=CC(=CC=C3)C(=O)[O-])C4=CC=CC=C4.[Na+]

InChI

InChI=1S/C28H23NO4.Na/c1-33-26-15-13-21(14-16-26)27(30)29(25-11-3-2-4-12-25)19-20-7-5-8-22(17-20)23-9-6-10-24(18-23)28(31)32;/h2-18H,19H2,1H3,(H,31,32);/q;+1/p-1