ethyl 1-[2-[3-(4-methylphenyl)sulfonylindol-1-yl]ethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-[3-(4-methylphenyl)sulfonylindol-1-yl]ethanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-[3-(p-tolylsulfonyl)indol-1-yl]acetyl]piperidine-3-carboxylate CAS Name: 1-[2-[3-(4-methylphenyl)sulfonyl-1-indolyl]-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[3-(4-methylphenyl)sulfonylindol-1-yl]acetyl]piperidine-3-carboxylate Traditional Name: 1-[2-(3-tosylindol-1-yl)acetyl]nipecotic acid ethyl ester Formula: C25H28N2O5S MolecularWeight: 468.56522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CN2C=C(C3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CN2C=C(C3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H28N2O5S/c1-3-32-25(29)19-7-6-14-26(15-19)24(28)17-27-16-23(21-8-4-5-9-22(21)27)33(30,31)20-12-10-18(2)11-13-20/h4-5,8-13,16,19H,3,6-7,14-15,17H2,1-2H3