N-[3-(azepan-1-yl)-1-(furan-2-yl)-3-oxidanylidene-propyl]-4-methoxy-benzenesulfonamide

Systemtic Name: N-[3-(azepan-1-yl)-1-(furan-2-yl)-3-oxidanylidene-propyl]-4-methoxy-benzenesulfonamide Openeye Name: N-[3-(azepan-1-yl)-1-(2-furyl)-3-oxo-propyl]-4-methoxy-benzenesulfonamide CAS Name: N-[3-(1-azepanyl)-1-(2-furanyl)-3-oxopropyl]-4-methoxybenzenesulfonamide IUPAC Name: N-[3-(azepan-1-yl)-1-(furan-2-yl)-3-oxopropyl]-4-methoxybenzenesulfonamide Traditional Name: N-[3-(azepan-1-yl)-1-(2-furyl)-3-keto-propyl]-4-methoxy-benzenesulfonamide Formula: C20H26N2O5S MolecularWeight: 406.49584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)N2CCCCCC2)C3=CC=CO3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)N2CCCCCC2)C3=CC=CO3

InChI

InChI=1S/C20H26N2O5S/c1-26-16-8-10-17(11-9-16)28(24,25)21-18(19-7-6-14-27-19)15-20(23)22-12-4-2-3-5-13-22/h6-11,14,18,21H,2-5,12-13,15H2,1H3