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

Systemtic Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[2-(2-fluorophenyl)ethyl]butanamide Openeye Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[2-(2-fluorophenyl)ethyl]butanamide CAS Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[2-(2-fluorophenyl)ethyl]butanamide IUPAC Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[2-(2-fluorophenyl)ethyl]butanamide Traditional Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[2-(2-fluorophenyl)ethyl]butyramide Formula: C21H25FN2O5S MolecularWeight: 436.497003

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NCCCC(=O)NCCC3=CC=CC=C3F)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NCCCC(=O)NCCC3=CC=CC=C3F)OC1

InChI

InChI=1S/C21H25FN2O5S/c22-18-6-2-1-5-16(18)10-12-23-21(25)7-3-11-24-30(26,27)17-8-9-19-20(15-17)29-14-4-13-28-19/h1-2,5-6,8-9,15,24H,3-4,7,10-14H2,(H,23,25)