[4-(2-fluorophenyl)carbonylpiperazin-1-yl]-(4-hexoxy-3-methoxy-phenyl)methanone

Systemtic Name: [4-(2-fluorophenyl)carbonylpiperazin-1-yl]-(4-hexoxy-3-methoxy-phenyl)methanone Openeye Name: [4-(2-fluorobenzoyl)piperazin-1-yl]-(4-hexoxy-3-methoxy-phenyl)methanone CAS Name: [4-[(2-fluorophenyl)-oxomethyl]-1-piperazinyl]-(4-hexoxy-3-methoxyphenyl)methanone IUPAC Name: [4-(2-fluorobenzoyl)piperazin-1-yl]-(4-hexoxy-3-methoxyphenyl)methanone Traditional Name: [4-(2-fluorobenzoyl)piperazino]-(4-hexoxy-3-methoxy-phenyl)methanone Formula: C25H31FN2O4 MolecularWeight: 442.523043

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3F)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3F)OC

InChI

InChI=1S/C25H31FN2O4/c1-3-4-5-8-17-32-22-12-11-19(18-23(22)31-2)24(29)27-13-15-28(16-14-27)25(30)20-9-6-7-10-21(20)26/h6-7,9-12,18H,3-5,8,13-17H2,1-2H3