(2S)-6-azanyl-2-[(4-bromophenyl)sulfonyl-(9H-fluoren-9-ylmethoxycarbonyl)amino]hexanoic acid

Systemtic Name: (2S)-6-azanyl-2-[(4-bromophenyl)sulfonyl-(9H-fluoren-9-ylmethoxycarbonyl)amino]hexanoic acid Openeye Name: (2S)-6-amino-2-[(4-bromophenyl)sulfonyl-(9H-fluoren-9-ylmethoxycarbonyl)amino]hexanoic acid CAS Name: (2S)-6-amino-2-[(4-bromophenyl)sulfonyl-[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]hexanoic acid IUPAC Name: (2S)-6-amino-2-[(4-bromophenyl)sulfonyl-(9H-fluoren-9-ylmethoxycarbonyl)amino]hexanoic acid Traditional Name: (2S)-6-amino-2-[brosyl(9H-fluoren-9-ylmethoxycarbonyl)amino]hexanoic acid Formula: C27H27BrN2O6S MolecularWeight: 587.48208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N(C(CCCCN)C(=O)O)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N([C@@H](CCCCN)C(=O)O)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C27H27BrN2O6S/c28-18-12-14-19(15-13-18)37(34,35)30(25(26(31)32)11-5-6-16-29)27(33)36-17-24-22-9-3-1-7-20(22)21-8-2-4-10-23(21)24/h1-4,7-10,12-15,24-25H,5-6,11,16-17,29H2,(H,31,32)/t25-/m0/s1