ethyl 1-isoquinolin-5-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-isoquinolin-5-ylsulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(5-isoquinolylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(5-isoquinolinylsulfonyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-isoquinolin-5-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(5-isoquinolylsulfonyl)isonipecotic acid ethyl ester Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C17H20N2O4S/c1-2-23-17(20)13-7-10-19(11-8-13)24(21,22)16-5-3-4-14-12-18-9-6-15(14)16/h3-6,9,12-13H,2,7-8,10-11H2,1H3