(3S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyridin-3-ylsulfonyl-piperidin-3-amine

Systemtic Name: (3S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyridin-3-ylsulfonyl-piperidin-3-amine Openeye Name: (3S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(3-pyridylsulfonyl)piperidin-3-amine CAS Name: (3S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(3-pyridinylsulfonyl)-3-piperidinamine IUPAC Name: (3S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyridin-3-ylsulfonylpiperidin-3-amine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[(3S)-1-(3-pyridylsulfonyl)-3-piperidyl]amine Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CN=CC=C2)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CN=CC=C2)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C18H21N3O4S/c22-26(23,16-4-1-7-19-12-16)21-8-2-3-15(13-21)20-14-5-6-17-18(11-14)25-10-9-24-17/h1,4-7,11-12,15,20H,2-3,8-10,13H2/t15-/m0/s1