[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 1-(4-ethanoylphenyl)sulfonylpiperidine-2-carboxylate

Systemtic Name: [2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 1-(4-ethanoylphenyl)sulfonylpiperidine-2-carboxylate Openeye Name: [2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl] 1-(4-acetylphenyl)sulfonylpiperidine-2-carboxylate CAS Name: 1-(4-acetylphenyl)sulfonyl-2-piperidinecarboxylic acid [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] 1-(4-acetylphenyl)sulfonylpiperidine-2-carboxylate Traditional Name: 1-(4-acetylphenyl)sulfonylpipecolinic acid [2-keto-2-(2-methyl-1H-indol-3-yl)ethyl] ester Formula: C25H26N2O6S MolecularWeight: 482.54874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)COC(=O)C3CCCCN3S(=O)(=O)C4=CC=C(C=C4)C(=O)C

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)COC(=O)C3CCCCN3S(=O)(=O)C4=CC=C(C=C4)C(=O)C

InChI

InChI=1S/C25H26N2O6S/c1-16-24(20-7-3-4-8-21(20)26-16)23(29)15-33-25(30)22-9-5-6-14-27(22)34(31,32)19-12-10-18(11-13-19)17(2)28/h3-4,7-8,10-13,22,26H,5-6,9,14-15H2,1-2H3