3-(azepan-1-ylsulfonyl)-N-(3-ethanoylphenyl)-4-methoxy-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(3-ethanoylphenyl)-4-methoxy-benzamide Openeye Name: N-(3-acetylphenyl)-3-(azepan-1-ylsulfonyl)-4-methoxy-benzamide CAS Name: N-(3-acetylphenyl)-3-(1-azepanylsulfonyl)-4-methoxybenzamide IUPAC Name: N-(3-acetylphenyl)-3-(azepan-1-ylsulfonyl)-4-methoxybenzamide Traditional Name: N-(3-acetylphenyl)-3-(azepan-1-ylsulfonyl)-4-methoxy-benzamide Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H26N2O5S/c1-16(25)17-8-7-9-19(14-17)23-22(26)18-10-11-20(29-2)21(15-18)30(27,28)24-12-5-3-4-6-13-24/h7-11,14-15H,3-6,12-13H2,1-2H3,(H,23,26)