4-[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-oxidanyl-3-oxidanylidene-propyl]benzoic acid

Systemtic Name: 4-[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-oxidanyl-3-oxidanylidene-propyl]benzoic acid Openeye Name: 4-[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-hydroxy-3-oxo-propyl]benzoic acid CAS Name: 4-[(2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-hydroxy-3-oxopropyl]benzoic acid IUPAC Name: 4-[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-hydroxy-3-oxopropyl]benzoic acid Traditional Name: 4-[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-hydroxy-3-keto-propyl]benzoic acid Formula: C25H21NO6 MolecularWeight: 431.43734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CC4=CC=C(C=C4)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CC=C(C=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C25H21NO6/c27-23(28)16-11-9-15(10-12-16)13-22(24(29)30)26-25(31)32-14-21-19-7-3-1-5-17(19)18-6-2-4-8-20(18)21/h1-12,21-22H,13-14H2,(H,26,31)(H,27,28)(H,29,30)/t22-/m0/s1