(3-chloranyl-1-benzothiophen-2-yl)-(6-ethoxy-2,2,4-trimethyl-quinolin-1-yl)methanone

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)-(6-ethoxy-2,2,4-trimethyl-quinolin-1-yl)methanone Openeye Name: (3-chlorobenzothiophen-2-yl)-(6-ethoxy-2,2,4-trimethyl-1-quinolyl)methanone CAS Name: (3-chloro-1-benzothiophen-2-yl)-(6-ethoxy-2,2,4-trimethyl-1-quinolinyl)methanone IUPAC Name: (3-chloro-1-benzothiophen-2-yl)-(6-ethoxy-2,2,4-trimethylquinolin-1-yl)methanone Traditional Name: (3-chlorobenzothiophen-2-yl)-(6-ethoxy-2,2,4-trimethyl-1-quinolyl)methanone Formula: C23H22ClNO2S MolecularWeight: 411.94428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(C=C2C)(C)C)C(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(C=C2C)(C)C)C(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C23H22ClNO2S/c1-5-27-15-10-11-18-17(12-15)14(2)13-23(3,4)25(18)22(26)21-20(24)16-8-6-7-9-19(16)28-21/h6-13H,5H2,1-4H3