3,5-dimethyl-2-(3-phenylpropanoylamino)benzoic acid

Systemtic Name: 3,5-dimethyl-2-(3-phenylpropanoylamino)benzoic acid Openeye Name: 3,5-dimethyl-2-(3-phenylpropanoylamino)benzoic acid CAS Name: 3,5-dimethyl-2-[(1-oxo-3-phenylpropyl)amino]benzoic acid IUPAC Name: 3,5-dimethyl-2-(3-phenylpropanoylamino)benzoic acid Traditional Name: 2-(hydrocinnamoylamino)-3,5-dimethyl-benzoic acid Formula: C18H19NO3 MolecularWeight: 297.34836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)O)NC(=O)CCC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C(=O)O)NC(=O)CCC2=CC=CC=C2)C

InChI

InChI=1S/C18H19NO3/c1-12-10-13(2)17(15(11-12)18(21)22)19-16(20)9-8-14-6-4-3-5-7-14/h3-7,10-11H,8-9H2,1-2H3,(H,19,20)(H,21,22)