3-methyl-4-(3-phenylpropanoylamino)benzoate

Systemtic Name: 3-methyl-4-(3-phenylpropanoylamino)benzoate Openeye Name: 3-methyl-4-(3-phenylpropanoylamino)benzoate CAS Name: 3-methyl-4-[(1-oxo-3-phenylpropyl)amino]benzoate IUPAC Name: 3-methyl-4-(3-phenylpropanoylamino)benzoate Traditional Name: 4-(hydrocinnamoylamino)-3-methyl-benzoate Formula: C17H16NO3- MolecularWeight: 282.31384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)[O-])NC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)[O-])NC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C17H17NO3/c1-12-11-14(17(20)21)8-9-15(12)18-16(19)10-7-13-5-3-2-4-6-13/h2-6,8-9,11H,7,10H2,1H3,(H,18,19)(H,20,21)/p-1