[2-oxidanylidene-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl] 4-methyl-3-oxidanyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl] 4-methyl-3-oxidanyl-benzoate Openeye Name: [2-oxo-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl] 3-hydroxy-4-methyl-benzoate CAS Name: 3-hydroxy-4-methylbenzoic acid [2-oxo-2-[4-(2-phenoxyethyl)-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl] 3-hydroxy-4-methylbenzoate Traditional Name: 3-hydroxy-4-methyl-benzoic acid [2-keto-2-[4-(2-phenoxyethyl)piperazino]ethyl] ester Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)N2CCN(CC2)CCOC3=CC=CC=C3)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)N2CCN(CC2)CCOC3=CC=CC=C3)O

InChI

InChI=1S/C22H26N2O5/c1-17-7-8-18(15-20(17)25)22(27)29-16-21(26)24-11-9-23(10-12-24)13-14-28-19-5-3-2-4-6-19/h2-8,15,25H,9-14,16H2,1H3