ethyl (3R)-3-(phenylmethyl)-1-quinolin-8-ylsulfonyl-piperidine-3-carboxylate

Systemtic Name: ethyl (3R)-3-(phenylmethyl)-1-quinolin-8-ylsulfonyl-piperidine-3-carboxylate Openeye Name: ethyl (3R)-3-benzyl-1-(8-quinolylsulfonyl)piperidine-3-carboxylate CAS Name: (3R)-3-(phenylmethyl)-1-(8-quinolinylsulfonyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-3-benzyl-1-quinolin-8-ylsulfonylpiperidine-3-carboxylate Traditional Name: (3R)-3-benzyl-1-(8-quinolylsulfonyl)nipecotic acid ethyl ester Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)S(=O)(=O)C2=CC=CC3=C2N=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)[C@]1(CCCN(C1)S(=O)(=O)C2=CC=CC3=C2N=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C24H26N2O4S/c1-2-30-23(27)24(17-19-9-4-3-5-10-19)14-8-16-26(18-24)31(28,29)21-13-6-11-20-12-7-15-25-22(20)21/h3-7,9-13,15H,2,8,14,16-18H2,1H3/t24-/m1/s1