phenacyl 4-(4-methylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: phenacyl 4-(4-methylpiperidin-1-yl)sulfonylbenzoate Openeye Name: phenacyl 4-[(4-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-[(4-methyl-1-piperidinyl)sulfonyl]benzoic acid phenacyl ester IUPAC Name: phenacyl 4-(4-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-(4-methylpiperidino)sulfonylbenzoic acid phenacyl ester Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H23NO5S/c1-16-11-13-22(14-12-16)28(25,26)19-9-7-18(8-10-19)21(24)27-15-20(23)17-5-3-2-4-6-17/h2-10,16H,11-15H2,1H3