2-[3-(3,4-dimethoxyphenyl)propanoylamino]benzoate

Systemtic Name: 2-[3-(3,4-dimethoxyphenyl)propanoylamino]benzoate Openeye Name: 2-[3-(3,4-dimethoxyphenyl)propanoylamino]benzoate CAS Name: 2-[[3-(3,4-dimethoxyphenyl)-1-oxopropyl]amino]benzoate IUPAC Name: 2-[3-(3,4-dimethoxyphenyl)propanoylamino]benzoate Traditional Name: 2-[3-(3,4-dimethoxyphenyl)propanoylamino]benzoate Formula: C18H18NO5- MolecularWeight: 328.33922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)NC2=CC=CC=C2C(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)NC2=CC=CC=C2C(=O)[O-])OC

InChI

InChI=1S/C18H19NO5/c1-23-15-9-7-12(11-16(15)24-2)8-10-17(20)19-14-6-4-3-5-13(14)18(21)22/h3-7,9,11H,8,10H2,1-2H3,(H,19,20)(H,21,22)/p-1