3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(2,5-diethoxyphenyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(2,5-diethoxyphenyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2,5-diethoxyphenyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-(2,5-diethoxyphenyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2,5-diethoxyphenyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2,5-diethoxyphenyl)benzamide Formula: C23H29ClN2O5S MolecularWeight: 481.00476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H29ClN2O5S/c1-3-30-18-10-12-21(31-4-2)20(16-18)25-23(27)17-9-11-19(24)22(15-17)32(28,29)26-13-7-5-6-8-14-26/h9-12,15-16H,3-8,13-14H2,1-2H3,(H,25,27)