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

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[1-(4-ethoxy-3-methoxyphenyl)ethyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[1-(4-ethoxy-3-methoxyphenyl)ethyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]benzamide Formula: C24H32N2O5S MolecularWeight: 460.58628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32N2O5S/c1-4-31-22-13-12-19(17-23(22)30-3)18(2)25-24(27)20-10-9-11-21(16-20)32(28,29)26-14-7-5-6-8-15-26/h9-13,16-18H,4-8,14-15H2,1-3H3,(H,25,27)