N-[2-(3-chlorophenyl)ethyl]-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)butanamide

Systemtic Name: N-[2-(3-chlorophenyl)ethyl]-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)butanamide Openeye Name: N-[2-(3-chlorophenyl)ethyl]-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)butanamide CAS Name: N-[2-(3-chlorophenyl)ethyl]-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)butanamide IUPAC Name: N-[2-(3-chlorophenyl)ethyl]-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)butanamide Traditional Name: N-[2-(3-chlorophenyl)ethyl]-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)butyramide Formula: C21H25ClN2O5S MolecularWeight: 452.9516

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NCCCC(=O)NCCC3=CC(=CC=C3)Cl)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NCCCC(=O)NCCC3=CC(=CC=C3)Cl)OC1

InChI

InChI=1S/C21H25ClN2O5S/c22-17-5-1-4-16(14-17)9-11-23-21(25)6-2-10-24-30(26,27)18-7-8-19-20(15-18)29-13-3-12-28-19/h1,4-5,7-8,14-15,24H,2-3,6,9-13H2,(H,23,25)