sodium 4-[4-[methyl(phenylcarbonyl)amino]phenyl]butanoate

Systemtic Name: sodium 4-[4-[methyl(phenylcarbonyl)amino]phenyl]butanoate Openeye Name: sodium 4-[4-[benzoyl(methyl)amino]phenyl]butanoate CAS Name: sodium 4-[4-[benzoyl(methyl)amino]phenyl]butanoate IUPAC Name: sodium 4-[4-[benzoyl(methyl)amino]phenyl]butanoate Traditional Name: sodium 4-[4-[benzoyl(methyl)amino]phenyl]butyrate Formula: C18H18NNaO3 MolecularWeight: 319.33019

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)CCCC(=O)[O-])C(=O)C2=CC=CC=C2.[Na+]

Isomeric SMILES

CN(C1=CC=C(C=C1)CCCC(=O)[O-])C(=O)C2=CC=CC=C2.[Na+]

InChI

InChI=1S/C18H19NO3.Na/c1-19(18(22)15-7-3-2-4-8-15)16-12-10-14(11-13-16)6-5-9-17(20)21;/h2-4,7-8,10-13H,5-6,9H2,1H3,(H,20,21);/q;+1/p-1