N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-5-pyrrolidinosulfonyl-benzamide Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C21H24N2O5S/c1-15-5-7-17(29(25,26)23-9-2-3-10-23)14-18(15)21(24)22-16-6-8-19-20(13-16)28-12-4-11-27-19/h5-8,13-14H,2-4,9-12H2,1H3,(H,22,24)