(phenylmethyl) 4-[2-[1-(4-methylphenyl)sulfonyloxyindol-3-yl]-2-oxidanylidene-ethyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[2-[1-(4-methylphenyl)sulfonyloxyindol-3-yl]-2-oxidanylidene-ethyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[2-oxo-2-[1-(p-tolylsulfonyloxy)indol-3-yl]ethyl]piperidine-1-carboxylate CAS Name: 4-[2-[1-(4-methylphenyl)sulfonyloxy-3-indolyl]-2-oxoethyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[2-[1-(4-methylphenyl)sulfonyloxyindol-3-yl]-2-oxoethyl]piperidine-1-carboxylate Traditional Name: 4-[2-keto-2-(1-tosyloxyindol-3-yl)ethyl]piperidine-1-carboxylic acid benzyl ester Formula: C30H30N2O6S MolecularWeight: 546.634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)ON2C=C(C3=CC=CC=C32)C(=O)CC4CCN(CC4)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)ON2C=C(C3=CC=CC=C32)C(=O)CC4CCN(CC4)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C30H30N2O6S/c1-22-11-13-25(14-12-22)39(35,36)38-32-20-27(26-9-5-6-10-28(26)32)29(33)19-23-15-17-31(18-16-23)30(34)37-21-24-7-3-2-4-8-24/h2-14,20,23H,15-19,21H2,1H3