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

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

Systemtic Name:3-(azepan-1-ylsulfonyl)-N-(2,5-diethoxyphenyl)benzamide
Openeye Name:3-(azepan-1-ylsulfonyl)-N-(2,5-diethoxyphenyl)benzamide
CAS Name:3-(1-azepanylsulfonyl)-N-(2,5-diethoxyphenyl)benzamide
IUPAC Name:3-(azepan-1-ylsulfonyl)-N-(2,5-diethoxyphenyl)benzamide
Traditional Name:3-(azepan-1-ylsulfonyl)-N-(2,5-diethoxyphenyl)benzamide
Formula: C23H30N2O5S
MolecularWeight: 446.5597
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C23H30N2O5S/c1-3-29-19-12-13-22(30-4-2)21(17-19)24-23(26)18-10-9-11-20(16-18)31(27,28)25-14-7-5-6-8-15-25/h9-13,16-17H,3-8,14-15H2,1-2H3,(H,24,26)


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