(4-methoxyphenyl)methyl 4-(azepan-1-ylsulfonyl)benzoate

Systemtic Name: (4-methoxyphenyl)methyl 4-(azepan-1-ylsulfonyl)benzoate Openeye Name: (4-methoxyphenyl)methyl 4-(azepan-1-ylsulfonyl)benzoate CAS Name: 4-(1-azepanylsulfonyl)benzoic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 4-(azepan-1-ylsulfonyl)benzoate Traditional Name: 4-(azepan-1-ylsulfonyl)benzoic acid p-anisyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C21H25NO5S/c1-26-19-10-6-17(7-11-19)16-27-21(23)18-8-12-20(13-9-18)28(24,25)22-14-4-2-3-5-15-22/h6-13H,2-5,14-16H2,1H3