[4-(4-ethanoylpiperazin-1-yl)phenyl] 3,5-dimethylbenzoate

Systemtic Name: [4-(4-ethanoylpiperazin-1-yl)phenyl] 3,5-dimethylbenzoate Openeye Name: [4-(4-acetylpiperazin-1-yl)phenyl] 3,5-dimethylbenzoate CAS Name: 3,5-dimethylbenzoic acid [4-(4-acetyl-1-piperazinyl)phenyl] ester IUPAC Name: [4-(4-acetylpiperazin-1-yl)phenyl] 3,5-dimethylbenzoate Traditional Name: 3,5-dimethylbenzoic acid [4-(4-acetylpiperazino)phenyl] ester Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)OC2=CC=C(C=C2)N3CCN(CC3)C(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)OC2=CC=C(C=C2)N3CCN(CC3)C(=O)C)C

InChI

InChI=1S/C21H24N2O3/c1-15-12-16(2)14-18(13-15)21(25)26-20-6-4-19(5-7-20)23-10-8-22(9-11-23)17(3)24/h4-7,12-14H,8-11H2,1-3H3