3-[4-(azepan-1-ylmethyl)phenyl]-4-(2-cyclopropylethoxy)-2-ethyl-benzamide

Systemtic Name: 3-[4-(azepan-1-ylmethyl)phenyl]-4-(2-cyclopropylethoxy)-2-ethyl-benzamide Openeye Name: 3-[4-(azepan-1-ylmethyl)phenyl]-4-(2-cyclopropylethoxy)-2-ethyl-benzamide CAS Name: 3-[4-(1-azepanylmethyl)phenyl]-4-(2-cyclopropylethoxy)-2-ethylbenzamide IUPAC Name: 3-[4-(azepan-1-ylmethyl)phenyl]-4-(2-cyclopropylethoxy)-2-ethylbenzamide Traditional Name: 3-[4-(azepan-1-ylmethyl)phenyl]-4-(2-cyclopropylethoxy)-2-ethyl-benzamide Formula: C27H36N2O2 MolecularWeight: 420.58694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1C2=CC=C(C=C2)CN3CCCCCC3)OCCC4CC4)C(=O)N

Isomeric SMILES

CCC1=C(C=CC(=C1C2=CC=C(C=C2)CN3CCCCCC3)OCCC4CC4)C(=O)N

InChI

InChI=1S/C27H36N2O2/c1-2-23-24(27(28)30)13-14-25(31-18-15-20-7-8-20)26(23)22-11-9-21(10-12-22)19-29-16-5-3-4-6-17-29/h9-14,20H,2-8,15-19H2,1H3,(H2,28,30)