5-(azepan-1-ylsulfonyl)-N-[(4-ethoxyphenyl)methyl]-2-methoxy-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-[(4-ethoxyphenyl)methyl]-2-methoxy-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-[(4-ethoxyphenyl)methyl]-2-methoxy-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-[(4-ethoxyphenyl)methyl]-2-methoxybenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-[(4-ethoxyphenyl)methyl]-2-methoxybenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-(4-ethoxybenzyl)-2-methoxy-benzamide Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C23H30N2O5S/c1-3-30-19-10-8-18(9-11-19)17-24-23(26)21-16-20(12-13-22(21)29-2)31(27,28)25-14-6-4-5-7-15-25/h8-13,16H,3-7,14-15,17H2,1-2H3,(H,24,26)