methyl 4-[[3-(2-hydroxyethyl)-4-(1-methylpiperidin-4-yl)piperazin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[3-(2-hydroxyethyl)-4-(1-methylpiperidin-4-yl)piperazin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[3-(2-hydroxyethyl)-4-(1-methyl-4-piperidyl)piperazin-1-yl]methyl]benzoate CAS Name: 4-[[3-(2-hydroxyethyl)-4-(1-methyl-4-piperidinyl)-1-piperazinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(2-hydroxyethyl)-4-(1-methylpiperidin-4-yl)piperazin-1-yl]methyl]benzoate Traditional Name: 4-[[3-(2-hydroxyethyl)-4-(1-methyl-4-piperidyl)piperazino]methyl]benzoic acid methyl ester Formula: C21H33N3O3 MolecularWeight: 375.50502

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N2CCN(CC2CCO)CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CN1CCC(CC1)N2CCN(CC2CCO)CC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H33N3O3/c1-22-10-7-19(8-11-22)24-13-12-23(16-20(24)9-14-25)15-17-3-5-18(6-4-17)21(26)27-2/h3-6,19-20,25H,7-16H2,1-2H3