ethyl 1-[2-[3-(phenylsulfonyl)indol-1-yl]ethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-[3-(phenylsulfonyl)indol-1-yl]ethanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-[3-(benzenesulfonyl)indol-1-yl]acetyl]piperidine-3-carboxylate CAS Name: 1-[2-[3-(benzenesulfonyl)-1-indolyl]-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[3-(benzenesulfonyl)indol-1-yl]acetyl]piperidine-3-carboxylate Traditional Name: 1-[2-(3-besylindol-1-yl)acetyl]nipecotic acid ethyl ester Formula: C24H26N2O5S MolecularWeight: 454.53864

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C24H26N2O5S/c1-2-31-24(28)18-9-8-14-25(15-18)23(27)17-26-16-22(20-12-6-7-13-21(20)26)32(29,30)19-10-4-3-5-11-19/h3-7,10-13,16,18H,2,8-9,14-15,17H2,1H3