N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[(4-chlorophenyl)methoxy]benzamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[(4-chlorophenyl)methoxy]benzamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[(4-chlorophenyl)methoxy]benzamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-[(4-chlorophenyl)methoxy]benzamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-[(4-chlorophenyl)methoxy]benzamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(4-chlorobenzyl)oxy-benzamide Formula: C27H29ClN2O4S MolecularWeight: 513.04816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2OCC3=CC=C(C=C3)Cl)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2OCC3=CC=C(C=C3)Cl)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C27H29ClN2O4S/c1-20-10-15-23(18-26(20)35(32,33)30-16-6-2-3-7-17-30)29-27(31)24-8-4-5-9-25(24)34-19-21-11-13-22(28)14-12-21/h4-5,8-15,18H,2-3,6-7,16-17,19H2,1H3,(H,29,31)