3-(azepan-1-ylcarbonyl)-N-[1-(3,4-diethoxyphenyl)ethyl]-4-methoxy-benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-N-[1-(3,4-diethoxyphenyl)ethyl]-4-methoxy-benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-N-[1-(3,4-diethoxyphenyl)ethyl]-4-methoxy-benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-N-[1-(3,4-diethoxyphenyl)ethyl]-4-methoxybenzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-N-[1-(3,4-diethoxyphenyl)ethyl]-4-methoxybenzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-N-[1-(3,4-diethoxyphenyl)ethyl]-4-methoxy-benzenesulfonamide Formula: C26H36N2O6S MolecularWeight: 504.63884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCCC3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C)NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCCC3)OCC

InChI

InChI=1S/C26H36N2O6S/c1-5-33-24-13-11-20(17-25(24)34-6-2)19(3)27-35(30,31)21-12-14-23(32-4)22(18-21)26(29)28-15-9-7-8-10-16-28/h11-14,17-19,27H,5-10,15-16H2,1-4H3