N-[3-(azepan-1-ylsulfonyl)phenyl]-4-ethyl-benzamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-ethyl-benzamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-ethyl-benzamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-4-ethylbenzamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-ethylbenzamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-ethyl-benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C21H26N2O3S/c1-2-17-10-12-18(13-11-17)21(24)22-19-8-7-9-20(16-19)27(25,26)23-14-5-3-4-6-15-23/h7-13,16H,2-6,14-15H2,1H3,(H,22,24)