2-chloranyl-5-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]sulfonyl-pyridine

Systemtic Name: 2-chloranyl-5-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]sulfonyl-pyridine Openeye Name: 2-chloro-5-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]sulfonyl-pyridine CAS Name: 2-chloro-5-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]sulfonyl]pyridine IUPAC Name: 2-chloro-5-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]sulfonylpyridine Traditional Name: 2-chloro-5-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]sulfonyl-pyridine Formula: C18H19ClN2O4S MolecularWeight: 394.87246

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CN=C(C=C2)Cl)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CN=C(C=C2)Cl)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C18H19ClN2O4S/c19-18-7-5-14(12-20-18)26(22,23)21-8-1-3-15(21)13-4-6-16-17(11-13)25-10-2-9-24-16/h4-7,11-12,15H,1-3,8-10H2