(3S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-3-(4-methyl-1H-pyrazol-5-yl)piperidine

Systemtic Name: (3S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-3-(4-methyl-1H-pyrazol-5-yl)piperidine Openeye Name: (3S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-3-(4-methyl-1H-pyrazol-5-yl)piperidine CAS Name: (3S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-3-(4-methyl-1H-pyrazol-5-yl)piperidine IUPAC Name: (3S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-3-(4-methyl-1H-pyrazol-5-yl)piperidine Traditional Name: (3S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-3-(4-methyl-1H-pyrazol-5-yl)piperidine Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NN=C1)C2CCCN(C2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=C(NN=C1)[C@H]2CCCN(C2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C17H21N3O4S/c1-12-10-18-19-17(12)13-3-2-6-20(11-13)25(21,22)14-4-5-15-16(9-14)24-8-7-23-15/h4-5,9-10,13H,2-3,6-8,11H2,1H3,(H,18,19)/t13-/m0/s1