(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-[4-(2-fluorophenyl)piperazin-1-yl]methanone

Systemtic Name: (3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-[4-(2-fluorophenyl)piperazin-1-yl]methanone Openeye Name: (4-benzyloxy-3-bromo-5-methoxy-phenyl)-[4-(2-fluorophenyl)piperazin-1-yl]methanone CAS Name: (3-bromo-5-methoxy-4-phenylmethoxyphenyl)-[4-(2-fluorophenyl)-1-piperazinyl]methanone IUPAC Name: (3-bromo-5-methoxy-4-phenylmethoxyphenyl)-[4-(2-fluorophenyl)piperazin-1-yl]methanone Traditional Name: (4-benzoxy-3-bromo-5-methoxy-phenyl)-[4-(2-fluorophenyl)piperazino]methanone Formula: C25H24BrFN2O3 MolecularWeight: 499.372063

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3F)Br)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3F)Br)OCC4=CC=CC=C4

InChI

InChI=1S/C25H24BrFN2O3/c1-31-23-16-19(15-20(26)24(23)32-17-18-7-3-2-4-8-18)25(30)29-13-11-28(12-14-29)22-10-6-5-9-21(22)27/h2-10,15-16H,11-14,17H2,1H3