4-(9H-fluoren-9-ylmethoxycarbonyl)-1-[5-(4-fluorophenyl)thiophen-2-yl]sulfonyl-piperazine-2-carboxylic acid

Systemtic Name: 4-(9H-fluoren-9-ylmethoxycarbonyl)-1-[5-(4-fluorophenyl)thiophen-2-yl]sulfonyl-piperazine-2-carboxylic acid Openeye Name: 4-(9H-fluoren-9-ylmethoxycarbonyl)-1-[[5-(4-fluorophenyl)-2-thienyl]sulfonyl]piperazine-2-carboxylic acid CAS Name: 4-[9H-fluoren-9-ylmethoxy(oxo)methyl]-1-[[5-(4-fluorophenyl)-2-thiophenyl]sulfonyl]-2-piperazinecarboxylic acid IUPAC Name: 4-(9H-fluoren-9-ylmethoxycarbonyl)-1-[5-(4-fluorophenyl)thiophen-2-yl]sulfonylpiperazine-2-carboxylic acid Traditional Name: 4-(9H-fluoren-9-ylmethoxycarbonyl)-1-[[5-(4-fluorophenyl)-2-thienyl]sulfonyl]piperazine-2-carboxylic acid Formula: C30H25FN2O6S2 MolecularWeight: 592.657703

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O)S(=O)(=O)C5=CC=C(S5)C6=CC=C(C=C6)F

Isomeric SMILES

C1CN(C(CN1C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O)S(=O)(=O)C5=CC=C(S5)C6=CC=C(C=C6)F

InChI

InChI=1S/C30H25FN2O6S2/c31-20-11-9-19(10-12-20)27-13-14-28(40-27)41(37,38)33-16-15-32(17-26(33)29(34)35)30(36)39-18-25-23-7-3-1-5-21(23)22-6-2-4-8-24(22)25/h1-14,25-26H,15-18H2,(H,34,35)