(3-cyanophenyl)methyl 2-chloranyl-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate

Systemtic Name: (3-cyanophenyl)methyl 2-chloranyl-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate Openeye Name: (3-cyanophenyl)methyl 2-chloro-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate CAS Name: 2-chloro-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 2-chloro-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate Traditional Name: 2-chloro-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoic acid (3-cyanobenzyl) ester Formula: C24H19ClN2O4S MolecularWeight: 466.93666

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)OCC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)OCC4=CC=CC(=C4)C#N

InChI

InChI=1S/C24H19ClN2O4S/c25-22-11-10-20(32(29,30)27-12-4-8-19-7-1-2-9-23(19)27)14-21(22)24(28)31-16-18-6-3-5-17(13-18)15-26/h1-3,5-7,9-11,13-14H,4,8,12,16H2