3-cyanopropyl 2-[3-(4-methoxyphenyl)propanoylamino]benzoate

Systemtic Name: 3-cyanopropyl 2-[3-(4-methoxyphenyl)propanoylamino]benzoate Openeye Name: 3-cyanopropyl 2-[3-(4-methoxyphenyl)propanoylamino]benzoate CAS Name: 2-[[3-(4-methoxyphenyl)-1-oxopropyl]amino]benzoic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 2-[3-(4-methoxyphenyl)propanoylamino]benzoate Traditional Name: 2-[3-(4-methoxyphenyl)propanoylamino]benzoic acid 3-cyanopropyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=O)NC2=CC=CC=C2C(=O)OCCCC#N

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=O)NC2=CC=CC=C2C(=O)OCCCC#N

InChI

InChI=1S/C21H22N2O4/c1-26-17-11-8-16(9-12-17)10-13-20(24)23-19-7-3-2-6-18(19)21(25)27-15-5-4-14-22/h2-3,6-9,11-12H,4-5,10,13,15H2,1H3,(H,23,24)