4-[4-(2-methylbutanoylamino)phenyl]benzoic acid

Systemtic Name: 4-[4-(2-methylbutanoylamino)phenyl]benzoic acid Openeye Name: 4-[4-(2-methylbutanoylamino)phenyl]benzoic acid CAS Name: 4-[4-[(2-methyl-1-oxobutyl)amino]phenyl]benzoic acid IUPAC Name: 4-[4-(2-methylbutanoylamino)phenyl]benzoic acid Traditional Name: 4-[4-(2-methylbutanoylamino)phenyl]benzoic acid Formula: C18H19NO3 MolecularWeight: 297.34836

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)NC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCC(C)C(=O)NC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C18H19NO3/c1-3-12(2)17(20)19-16-10-8-14(9-11-16)13-4-6-15(7-5-13)18(21)22/h4-12H,3H2,1-2H3,(H,19,20)(H,21,22)