[1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2,4-dimethylbenzoate

Systemtic Name: [1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2,4-dimethylbenzoate Openeye Name: [1-methyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 2,4-dimethylbenzoate CAS Name: 2,4-dimethylbenzoic acid [1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2,4-dimethylbenzoate Traditional Name: 2,4-dimethylbenzoic acid [2-keto-1-methyl-2-(4-phenylpiperazino)ethyl] ester Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)OC(C)C(=O)N2CCN(CC2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)OC(C)C(=O)N2CCN(CC2)C3=CC=CC=C3)C

InChI

InChI=1S/C22H26N2O3/c1-16-9-10-20(17(2)15-16)22(26)27-18(3)21(25)24-13-11-23(12-14-24)19-7-5-4-6-8-19/h4-10,15,18H,11-14H2,1-3H3