naphthalen-1-ylmethyl 4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: naphthalen-1-ylmethyl 4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate Openeye Name: 1-naphthylmethyl 4-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzoic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-(3,5-dimethylpiperidino)sulfonylbenzoic acid 1-naphthylmethyl ester Formula: C25H27NO4S MolecularWeight: 437.55118

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C25H27NO4S/c1-18-14-19(2)16-26(15-18)31(28,29)23-12-10-21(11-13-23)25(27)30-17-22-8-5-7-20-6-3-4-9-24(20)22/h3-13,18-19H,14-17H2,1-2H3