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

Systemtic Name: methyl 4-[[4-(2-phenoxypropanoyl)piperazin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-(2-phenoxypropanoyl)piperazin-1-yl]methyl]benzoate CAS Name: 4-[[4-(1-oxo-2-phenoxypropyl)-1-piperazinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(2-phenoxypropanoyl)piperazin-1-yl]methyl]benzoate Traditional Name: 4-[[4-(2-phenoxypropanoyl)piperazino]methyl]benzoic acid methyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CC2=CC=C(C=C2)C(=O)OC)OC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N1CCN(CC1)CC2=CC=C(C=C2)C(=O)OC)OC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O4/c1-17(28-20-6-4-3-5-7-20)21(25)24-14-12-23(13-15-24)16-18-8-10-19(11-9-18)22(26)27-2/h3-11,17H,12-16H2,1-2H3