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3-(azepan-1-ylsulfonyl)-4-methoxy-N-[3-(methoxymethyl)phenyl]benzamide
3-(azepan-1-ylsulfonyl)-4-methoxy-N-[3-(methoxymethyl)phenyl]benzamide
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Descriptors Computed from Structure
Canonical SMILES:
COCC1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3
Isomeric SMILES
COCC1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3
InChI
InChI=1S/C22H28N2O5S/c1-28-16-17-8-7-9-19(14-17)23-22(25)18-10-11-20(29-2)21(15-18)30(26,27)24-12-5-3-4-6-13-24/h7-11,14-15H,3-6,12-13,16H2,1-2H3,(H,23,25)
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