5-bromanyl-N-[(3-chloranyl-4-methoxy-phenyl)methyl]-2-(cyclopentylamino)benzamide hydrochloride

Systemtic Name: 5-bromanyl-N-[(3-chloranyl-4-methoxy-phenyl)methyl]-2-(cyclopentylamino)benzamide hydrochloride Openeye Name: 5-bromo-N-[(3-chloro-4-methoxy-phenyl)methyl]-2-(cyclopentylamino)benzamide hydrochloride CAS Name: 5-bromo-N-[(3-chloro-4-methoxyphenyl)methyl]-2-(cyclopentylamino)benzamide hydrochloride IUPAC Name: 5-bromo-N-[(3-chloro-4-methoxyphenyl)methyl]-2-(cyclopentylamino)benzamide hydrochloride Traditional Name: 5-bromo-N-(3-chloro-4-methoxy-benzyl)-2-(cyclopentylamino)benzamide hydrochloride Formula: C20H23BrCl2N2O2 MolecularWeight: 474.21882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=C(C=CC(=C2)Br)NC3CCCC3)Cl.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=C(C=CC(=C2)Br)NC3CCCC3)Cl.Cl

InChI

InChI=1S/C20H22BrClN2O2.ClH/c1-26-19-9-6-13(10-17(19)22)12-23-20(25)16-11-14(21)7-8-18(16)24-15-4-2-3-5-15;/h6-11,15,24H,2-5,12H2,1H3,(H,23,25);1H