methyl 4-(4-ethanoylpiperazin-1-yl)-3-[2-(3-methylphenoxy)ethanoylamino]benzoate

Systemtic Name: methyl 4-(4-ethanoylpiperazin-1-yl)-3-[2-(3-methylphenoxy)ethanoylamino]benzoate Openeye Name: methyl 4-(4-acetylpiperazin-1-yl)-3-[[2-(3-methylphenoxy)acetyl]amino]benzoate CAS Name: 4-(4-acetyl-1-piperazinyl)-3-[[2-(3-methylphenoxy)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(4-acetylpiperazin-1-yl)-3-[[2-(3-methylphenoxy)acetyl]amino]benzoate Traditional Name: 4-(4-acetylpiperazino)-3-[[2-(3-methylphenoxy)acetyl]amino]benzoic acid methyl ester Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCN(CC3)C(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C23H27N3O5/c1-16-5-4-6-19(13-16)31-15-22(28)24-20-14-18(23(29)30-3)7-8-21(20)26-11-9-25(10-12-26)17(2)27/h4-8,13-14H,9-12,15H2,1-3H3,(H,24,28)