methyl 2-[2-[4-(4-ethanoylphenyl)piperazin-1-yl]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[4-(4-ethanoylphenyl)piperazin-1-yl]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[4-(4-acetylphenyl)piperazin-1-yl]acetyl]amino]benzoate CAS Name: 2-[[2-[4-(4-acetylphenyl)-1-piperazinyl]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[4-(4-acetylphenyl)piperazin-1-yl]acetyl]amino]benzoate Traditional Name: 2-[[2-[4-(4-acetylphenyl)piperazino]acetyl]amino]benzoic acid methyl ester Formula: C22H25N3O4 MolecularWeight: 395.4516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)CC(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)CC(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C22H25N3O4/c1-16(26)17-7-9-18(10-8-17)25-13-11-24(12-14-25)15-21(27)23-20-6-4-3-5-19(20)22(28)29-2/h3-10H,11-15H2,1-2H3,(H,23,27)