3-(azepan-1-ylsulfonyl)-N-[(4-hydroxyphenyl)methyl]-4-methoxy-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[(4-hydroxyphenyl)methyl]-4-methoxy-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[(4-hydroxyphenyl)methyl]-4-methoxy-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[(4-hydroxyphenyl)methyl]-4-methoxybenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[(4-hydroxyphenyl)methyl]-4-methoxybenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(4-hydroxybenzyl)-4-methoxy-benzamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)O)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)O)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C21H26N2O5S/c1-28-19-11-8-17(21(25)22-15-16-6-9-18(24)10-7-16)14-20(19)29(26,27)23-12-4-2-3-5-13-23/h6-11,14,24H,2-5,12-13,15H2,1H3,(H,22,25)