naphthalen-1-ylmethyl 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: naphthalen-1-ylmethyl 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: 1-naphthylmethyl 2-chloro-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-chloro-5-(1-piperidinylsulfonyl)benzoic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 2-chloro-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-chloro-5-piperidinosulfonyl-benzoic acid 1-naphthylmethyl ester Formula: C23H22ClNO4S MolecularWeight: 443.94308

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H22ClNO4S/c24-22-12-11-19(30(27,28)25-13-4-1-5-14-25)15-21(22)23(26)29-16-18-9-6-8-17-7-2-3-10-20(17)18/h2-3,6-12,15H,1,4-5,13-14,16H2