2-[[4-[2-(9H-fluoren-2-yl)-2-oxidanylidene-ethyl]sulfanylphenyl]carbamoyl]benzoic acid

Systemtic Name: 2-[[4-[2-(9H-fluoren-2-yl)-2-oxidanylidene-ethyl]sulfanylphenyl]carbamoyl]benzoic acid Openeye Name: 2-[[4-[2-(9H-fluoren-2-yl)-2-oxo-ethyl]sulfanylphenyl]carbamoyl]benzoic acid CAS Name: 2-[[4-[[2-(9H-fluoren-2-yl)-2-oxoethyl]thio]anilino]-oxomethyl]benzoic acid IUPAC Name: 2-[[4-[2-(9H-fluoren-2-yl)-2-oxoethyl]sulfanylphenyl]carbamoyl]benzoic acid Traditional Name: 2-[[4-[[2-(9H-fluoren-2-yl)-2-keto-ethyl]thio]phenyl]carbamoyl]benzoic acid Formula: C29H21NO4S MolecularWeight: 479.54634

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C3=C1C=C(C=C3)C(=O)CSC4=CC=C(C=C4)NC(=O)C5=CC=CC=C5C(=O)O

Isomeric SMILES

C1C2=CC=CC=C2C3=C1C=C(C=C3)C(=O)CSC4=CC=C(C=C4)NC(=O)C5=CC=CC=C5C(=O)O

InChI

InChI=1S/C29H21NO4S/c31-27(19-9-14-24-20(16-19)15-18-5-1-2-6-23(18)24)17-35-22-12-10-21(11-13-22)30-28(32)25-7-3-4-8-26(25)29(33)34/h1-14,16H,15,17H2,(H,30,32)(H,33,34)