(phenylmethyl) 4-[2-fluoranyl-4-(1-pyrrolidin-1-ylethyl)phenyl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[2-fluoranyl-4-(1-pyrrolidin-1-ylethyl)phenyl]piperazine-1-carboxylate Openeye Name: benzyl 4-[2-fluoro-4-(1-pyrrolidin-1-ylethyl)phenyl]piperazine-1-carboxylate CAS Name: 4-[2-fluoro-4-[1-(1-pyrrolidinyl)ethyl]phenyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[2-fluoro-4-(1-pyrrolidin-1-ylethyl)phenyl]piperazine-1-carboxylate Traditional Name: 4-[2-fluoro-4-(1-pyrrolidinoethyl)phenyl]piperazine-1-carboxylic acid benzyl ester Formula: C24H30FN3O2 MolecularWeight: 411.512303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)N2CCN(CC2)C(=O)OCC3=CC=CC=C3)F)N4CCCC4

Isomeric SMILES

CC(C1=CC(=C(C=C1)N2CCN(CC2)C(=O)OCC3=CC=CC=C3)F)N4CCCC4

InChI

InChI=1S/C24H30FN3O2/c1-19(26-11-5-6-12-26)21-9-10-23(22(25)17-21)27-13-15-28(16-14-27)24(29)30-18-20-7-3-2-4-8-20/h2-4,7-10,17,19H,5-6,11-16,18H2,1H3