2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[2-(2-nitrophenyl)sulfanyl-1H-indol-3-yl]propanoic acid

Systemtic Name: 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[2-(2-nitrophenyl)sulfanyl-1H-indol-3-yl]propanoic acid Openeye Name: 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[2-(2-nitrophenyl)sulfanyl-1H-indol-3-yl]propanoic acid CAS Name: 2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-[2-[(2-nitrophenyl)thio]-1H-indol-3-yl]propanoic acid IUPAC Name: 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[2-(2-nitrophenyl)sulfanyl-1H-indol-3-yl]propanoic acid Traditional Name: 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[2-[(2-nitrophenyl)thio]-1H-indol-3-yl]propionic acid Formula: C32H25N3O6S MolecularWeight: 579.6224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CC4=C(NC5=CC=CC=C54)SC6=CC=CC=C6[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CC4=C(NC5=CC=CC=C54)SC6=CC=CC=C6[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C32H25N3O6S/c36-31(37)27(34-32(38)41-18-25-21-11-3-1-9-19(21)20-10-2-4-12-22(20)25)17-24-23-13-5-6-14-26(23)33-30(24)42-29-16-8-7-15-28(29)35(39)40/h1-16,25,27,33H,17-18H2,(H,34,38)(H,36,37)