azepan-1-yl-[6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2,3-dihydro-1,4-benzodioxin-2-yl]methanone

Systemtic Name: azepan-1-yl-[6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2,3-dihydro-1,4-benzodioxin-2-yl]methanone Openeye Name: azepan-1-yl-[6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2,3-dihydro-1,4-benzodioxin-2-yl]methanone CAS Name: 1-azepanyl-[6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2,3-dihydro-1,4-benzodioxin-2-yl]methanone IUPAC Name: azepan-1-yl-[6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2,3-dihydro-1,4-benzodioxin-2-yl]methanone Traditional Name: azepan-1-yl-[6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2,3-dihydro-1,4-benzodioxin-2-yl]methanone Formula: C24H28N2O5S MolecularWeight: 456.55452

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2COC3=C(O2)C=CC(=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2COC3=C(O2)C=CC(=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C24H28N2O5S/c27-24(25-12-5-1-2-6-13-25)23-17-30-22-15-20(9-10-21(22)31-23)32(28,29)26-14-11-18-7-3-4-8-19(18)16-26/h3-4,7-10,15,23H,1-2,5-6,11-14,16-17H2