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

Systemtic Name: methyl 4-[2-[4-(2-phenoxyethyl)piperazin-1-yl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[4-(2-phenoxyethyl)piperazin-1-yl]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[4-(2-phenoxyethyl)-1-piperazinyl]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[4-(2-phenoxyethyl)piperazin-1-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[4-(2-phenoxyethyl)piperazino]acetyl]amino]benzoic acid methyl ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CN2CCN(CC2)CCOC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CN2CCN(CC2)CCOC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O4/c1-28-22(27)18-7-9-19(10-8-18)23-21(26)17-25-13-11-24(12-14-25)15-16-29-20-5-3-2-4-6-20/h2-10H,11-17H2,1H3,(H,23,26)