ethyl 4-[4-[(2-fluoranyl-4-methoxy-phenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-[(2-fluoranyl-4-methoxy-phenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-[(2-fluoro-4-methoxy-phenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(2-fluoro-4-methoxyphenyl)methyl]-3-(2-hydroxyethyl)-1-piperazinyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(2-fluoro-4-methoxyphenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(2-fluoro-4-methoxy-benzyl)-3-(2-hydroxyethyl)piperazino]piperidine-1-carboxylic acid ethyl ester Formula: C22H34FN3O4 MolecularWeight: 423.521463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2CCN(C(C2)CCO)CC3=C(C=C(C=C3)OC)F

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2CCN(C(C2)CCO)CC3=C(C=C(C=C3)OC)F

InChI

InChI=1S/C22H34FN3O4/c1-3-30-22(28)24-9-6-18(7-10-24)26-12-11-25(19(16-26)8-13-27)15-17-4-5-20(29-2)14-21(17)23/h4-5,14,18-19,27H,3,6-13,15-16H2,1-2H3