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

Systemtic Name: naphthalen-1-ylmethyl 2-methyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: 1-naphthylmethyl 2-methyl-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-methyl-5-(1-piperidinylsulfonyl)benzoic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 2-methyl-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-methyl-5-piperidinosulfonyl-benzoic acid 1-naphthylmethyl ester Formula: C24H25NO4S MolecularWeight: 423.5246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H25NO4S/c1-18-12-13-21(30(27,28)25-14-5-2-6-15-25)16-23(18)24(26)29-17-20-10-7-9-19-8-3-4-11-22(19)20/h3-4,7-13,16H,2,5-6,14-15,17H2,1H3