N-[[5-chloranyl-7-(2,6-dimethylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]cyclobutanamine

Systemtic Name: N-[[5-chloranyl-7-(2,6-dimethylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]cyclobutanamine Openeye Name: N-[[5-chloro-7-(2,6-dimethylphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]cyclobutanamine CAS Name: N-[[5-chloro-7-(2,6-dimethylphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]cyclobutanamine IUPAC Name: N-[[5-chloro-7-(2,6-dimethylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]cyclobutanamine Traditional Name: [5-chloro-7-(2,6-dimethylphenyl)coumaran-2-yl]methyl-cyclobutyl-amine Formula: C21H24ClNO MolecularWeight: 341.87436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C2=CC(=CC3=C2OC(C3)CNC4CCC4)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C)C2=CC(=CC3=C2OC(C3)CNC4CCC4)Cl

InChI

InChI=1S/C21H24ClNO/c1-13-5-3-6-14(2)20(13)19-11-16(22)9-15-10-18(24-21(15)19)12-23-17-7-4-8-17/h3,5-6,9,11,17-18,23H,4,7-8,10,12H2,1-2H3