2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-iodanyl-benzoic acid

Systemtic Name: 2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-iodanyl-benzoic acid Openeye Name: 2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-iodo-benzoic acid CAS Name: 2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-5-iodobenzoic acid IUPAC Name: 2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-iodobenzoic acid Traditional Name: 2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-iodo-benzoic acid Formula: C22H16INO4 MolecularWeight: 485.27121

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC4=C(C=C(C=C4)I)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC4=C(C=C(C=C4)I)C(=O)O

InChI

InChI=1S/C22H16INO4/c23-13-9-10-20(18(11-13)21(25)26)24-22(27)28-12-19-16-7-3-1-5-14(16)15-6-2-4-8-17(15)19/h1-11,19H,12H2,(H,24,27)(H,25,26)