7,7-bis(4-fluorophenyl)-1-(4-nitrophenyl)sulfanyl-3-piperazin-1-yl-heptan-2-ol

Systemtic Name: 7,7-bis(4-fluorophenyl)-1-(4-nitrophenyl)sulfanyl-3-piperazin-1-yl-heptan-2-ol Openeye Name: 7,7-bis(4-fluorophenyl)-1-(4-nitrophenyl)sulfanyl-3-piperazin-1-yl-heptan-2-ol CAS Name: 7,7-bis(4-fluorophenyl)-1-[(4-nitrophenyl)thio]-3-(1-piperazinyl)-2-heptanol IUPAC Name: 7,7-bis(4-fluorophenyl)-1-(4-nitrophenyl)sulfanyl-3-piperazin-1-ylheptan-2-ol Traditional Name: 7,7-bis(4-fluorophenyl)-1-[(4-nitrophenyl)thio]-3-piperazino-heptan-2-ol Formula: C29H33F2N3O3S MolecularWeight: 541.652426

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(CCCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C(CSC4=CC=C(C=C4)[N+](=O)[O-])O

Isomeric SMILES

C1CN(CCN1)C(CCCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C(CSC4=CC=C(C=C4)[N+](=O)[O-])O

InChI

InChI=1S/C29H33F2N3O3S/c30-23-8-4-21(5-9-23)27(22-6-10-24(31)11-7-22)2-1-3-28(33-18-16-32-17-19-33)29(35)20-38-26-14-12-25(13-15-26)34(36)37/h4-15,27-29,32,35H,1-3,16-20H2