ethyl 4-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-[(4-fluorophenyl)methyl]amino]butanoate

Systemtic Name: ethyl 4-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-[(4-fluorophenyl)methyl]amino]butanoate Openeye Name: ethyl 4-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-[(4-fluorophenyl)methyl]amino]butanoate CAS Name: 4-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-[(4-fluorophenyl)methyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-[(4-fluorophenyl)methyl]amino]butanoate Traditional Name: 4-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-(4-fluorobenzyl)amino]butyric acid ethyl ester Formula: C21H24FNO6S MolecularWeight: 437.481763

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN(CC1=CC=C(C=C1)F)S(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCOC(=O)CCCN(CC1=CC=C(C=C1)F)S(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H24FNO6S/c1-2-27-21(24)4-3-11-23(15-16-5-7-17(22)8-6-16)30(25,26)18-9-10-19-20(14-18)29-13-12-28-19/h5-10,14H,2-4,11-13,15H2,1H3