N-[(2R)-3-[(2S)-2-ethylpiperidin-1-yl]-2-oxidanyl-propyl]isoquinoline-5-sulfonamide

Systemtic Name: N-[(2R)-3-[(2S)-2-ethylpiperidin-1-yl]-2-oxidanyl-propyl]isoquinoline-5-sulfonamide Openeye Name: N-[(2R)-3-[(2S)-2-ethyl-1-piperidyl]-2-hydroxy-propyl]isoquinoline-5-sulfonamide CAS Name: N-[(2R)-3-[(2S)-2-ethyl-1-piperidinyl]-2-hydroxypropyl]-5-isoquinolinesulfonamide IUPAC Name: N-[(2R)-3-[(2S)-2-ethylpiperidin-1-yl]-2-hydroxypropyl]isoquinoline-5-sulfonamide Traditional Name: N-[(2R)-3-[(2S)-2-ethylpiperidino]-2-hydroxy-propyl]isoquinoline-5-sulfonamide Formula: C19H27N3O3S MolecularWeight: 377.50098

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1CC(CNS(=O)(=O)C2=CC=CC3=C2C=CN=C3)O

Isomeric SMILES

CC[C@H]1CCCCN1C[C@H](CNS(=O)(=O)C2=CC=CC3=C2C=CN=C3)O

InChI

InChI=1S/C19H27N3O3S/c1-2-16-7-3-4-11-22(16)14-17(23)13-21-26(24,25)19-8-5-6-15-12-20-10-9-18(15)19/h5-6,8-10,12,16-17,21,23H,2-4,7,11,13-14H2,1H3/t16-,17-/m0/s1