azepan-1-yl-(6-pyrrolidin-1-ylsulfonyl-2,3-dihydro-1,4-benzodioxin-2-yl)methanone

Systemtic Name: azepan-1-yl-(6-pyrrolidin-1-ylsulfonyl-2,3-dihydro-1,4-benzodioxin-2-yl)methanone Openeye Name: azepan-1-yl-(6-pyrrolidin-1-ylsulfonyl-2,3-dihydro-1,4-benzodioxin-2-yl)methanone CAS Name: 1-azepanyl-[6-(1-pyrrolidinylsulfonyl)-2,3-dihydro-1,4-benzodioxin-2-yl]methanone IUPAC Name: azepan-1-yl-(6-pyrrolidin-1-ylsulfonyl-2,3-dihydro-1,4-benzodioxin-2-yl)methanone Traditional Name: azepan-1-yl-(6-pyrrolidinosulfonyl-2,3-dihydro-1,4-benzodioxin-2-yl)methanone Formula: C19H26N2O5S MolecularWeight: 394.48514

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2COC3=C(O2)C=CC(=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2COC3=C(O2)C=CC(=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C19H26N2O5S/c22-19(20-9-3-1-2-4-10-20)18-14-25-17-13-15(7-8-16(17)26-18)27(23,24)21-11-5-6-12-21/h7-8,13,18H,1-6,9-12,14H2