[2-(9H-fluoren-3-yl)-2-oxidanylidene-ethyl] 2-chloranyl-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate

Systemtic Name: [2-(9H-fluoren-3-yl)-2-oxidanylidene-ethyl] 2-chloranyl-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate Openeye Name: [2-(9H-fluoren-3-yl)-2-oxo-ethyl] 2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate CAS Name: 2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoic acid [2-(9H-fluoren-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(9H-fluoren-3-yl)-2-oxoethyl] 2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate Traditional Name: 2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoic acid [2-(9H-fluoren-3-yl)-2-keto-ethyl] ester Formula: C31H24ClNO5S MolecularWeight: 558.04396

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)OCC(=O)C4=CC5=C(CC6=CC=CC=C65)C=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)OCC(=O)C4=CC5=C(CC6=CC=CC=C65)C=C4

InChI

InChI=1S/C31H24ClNO5S/c32-29-12-11-25(39(36,37)33-14-13-20-5-1-2-7-24(20)18-33)17-28(29)31(35)38-19-30(34)23-10-9-22-15-21-6-3-4-8-26(21)27(22)16-23/h1-12,16-17H,13-15,18-19H2