1,2,2,3,3,4,4,5,5-nonamethyl-1-benzothiepin-1-ium

Systemtic Name: 1,2,2,3,3,4,4,5,5-nonamethyl-1-benzothiepin-1-ium Openeye Name: 1,2,2,3,3,4,4,5,5-nonamethyl-1-benzothiepin-1-ium CAS Name: 1,2,2,3,3,4,4,5,5-nonamethyl-1-benzothiepin-1-ium IUPAC Name: 1,2,2,3,3,4,4,5,5-nonamethyl-1-benzothiepin-1-ium Traditional Name: 1,2,2,3,3,4,4,5,5-nonamethyl-1-benzothiepin-1-ium Formula: C19H31S+ MolecularWeight: 291.51444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2[S+](C(C(C1(C)C)(C)C)(C)C)C)C

Isomeric SMILES

CC1(C2=CC=CC=C2[S+](C(C(C1(C)C)(C)C)(C)C)C)C

InChI

InChI=1S/C19H31S/c1-16(2)14-12-10-11-13-15(14)20(9)19(7,8)18(5,6)17(16,3)4/h10-13H,1-9H3/q+1