quinolin-8-ylmethyl 4-chloranyl-3-methylsulfonyl-benzoate

Systemtic Name: quinolin-8-ylmethyl 4-chloranyl-3-methylsulfonyl-benzoate Openeye Name: 8-quinolylmethyl 4-chloro-3-methylsulfonyl-benzoate CAS Name: 4-chloro-3-methylsulfonylbenzoic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 4-chloro-3-methylsulfonylbenzoate Traditional Name: 4-chloro-3-mesyl-benzoic acid 8-quinolylmethyl ester Formula: C18H14ClNO4S MolecularWeight: 375.82606

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC2=CC=CC3=C2N=CC=C3)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC2=CC=CC3=C2N=CC=C3)Cl

InChI

InChI=1S/C18H14ClNO4S/c1-25(22,23)16-10-13(7-8-15(16)19)18(21)24-11-14-5-2-4-12-6-3-9-20-17(12)14/h2-10H,11H2,1H3