N-[7,7-bis(4-fluorophenyl)-2-methoxy-3-piperazin-1-yl-heptyl]-N-methyl-aniline

Systemtic Name: N-[7,7-bis(4-fluorophenyl)-2-methoxy-3-piperazin-1-yl-heptyl]-N-methyl-aniline Openeye Name: N-[7,7-bis(4-fluorophenyl)-2-methoxy-3-piperazin-1-yl-heptyl]-N-methyl-aniline CAS Name: N-[7,7-bis(4-fluorophenyl)-2-methoxy-3-(1-piperazinyl)heptyl]-N-methylaniline IUPAC Name: N-[7,7-bis(4-fluorophenyl)-2-methoxy-3-piperazin-1-ylheptyl]-N-methylaniline Traditional Name: [7,7-bis(4-fluorophenyl)-2-methoxy-3-piperazino-heptyl]-methyl-phenyl-amine Formula: C31H39F2N3O MolecularWeight: 507.657666

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(C(CCCC(C1=CC=C(C=C1)F)C2=CC=C(C=C2)F)N3CCNCC3)OC)C4=CC=CC=C4

Isomeric SMILES

CN(CC(C(CCCC(C1=CC=C(C=C1)F)C2=CC=C(C=C2)F)N3CCNCC3)OC)C4=CC=CC=C4

InChI

InChI=1S/C31H39F2N3O/c1-35(28-7-4-3-5-8-28)23-31(37-2)30(36-21-19-34-20-22-36)10-6-9-29(24-11-15-26(32)16-12-24)25-13-17-27(33)18-14-25/h3-5,7-8,11-18,29-31,34H,6,9-10,19-23H2,1-2H3