2-[9-(5-chloranyl-1-benzothiophen-3-yl)carbazol-4-yl]oxyethanamine; methanesulfonic acid

Systemtic Name: 2-[9-(5-chloranyl-1-benzothiophen-3-yl)carbazol-4-yl]oxyethanamine; methanesulfonic acid Openeye Name: 2-[9-(5-chlorobenzothiophen-3-yl)carbazol-4-yl]oxyethanamine; methanesulfonic acid CAS Name: 2-[[9-(5-chloro-1-benzothiophen-3-yl)-4-carbazolyl]oxy]ethanamine; methanesulfonic acid IUPAC Name: 2-[9-(5-chloro-1-benzothiophen-3-yl)carbazol-4-yl]oxyethanamine; methanesulfonic acid Traditional Name: 2-[9-(5-chlorobenzothiophen-3-yl)carbazol-4-yl]oxyethylamine; mesylic acid Formula: C23H21ClN2O4S2 MolecularWeight: 489.00684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1=CC=C2C(=C1)C3=C(N2C4=CSC5=C4C=C(C=C5)Cl)C=CC=C3OCCN

Isomeric SMILES

CS(=O)(=O)O.C1=CC=C2C(=C1)C3=C(N2C4=CSC5=C4C=C(C=C5)Cl)C=CC=C3OCCN

InChI

InChI=1S/C22H17ClN2OS.CH4O3S/c23-14-8-9-21-16(12-14)19(13-27-21)25-17-5-2-1-4-15(17)22-18(25)6-3-7-20(22)26-11-10-24;1-5(2,3)4/h1-9,12-13H,10-11,24H2;1H3,(H,2,3,4)