4-bromanyl-1-[(4-methylpiperidin-1-ium-1-yl)methyl]indole-2,3-dione

Systemtic Name: 4-bromanyl-1-[(4-methylpiperidin-1-ium-1-yl)methyl]indole-2,3-dione Openeye Name: 4-bromo-1-[(4-methylpiperidin-1-ium-1-yl)methyl]indoline-2,3-dione CAS Name: 4-bromo-1-[(4-methyl-1-piperidin-1-iumyl)methyl]indole-2,3-dione IUPAC Name: 4-bromo-1-[(4-methylpiperidin-1-ium-1-yl)methyl]indole-2,3-dione Traditional Name: 4-bromo-1-[(4-methylpiperidin-1-ium-1-yl)methyl]isatin Formula: C15H18BrN2O2+ MolecularWeight: 338.21962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CN2C3=C(C(=CC=C3)Br)C(=O)C2=O

Isomeric SMILES

CC1CC[NH+](CC1)CN2C3=C(C(=CC=C3)Br)C(=O)C2=O

InChI

InChI=1S/C15H17BrN2O2/c1-10-5-7-17(8-6-10)9-18-12-4-2-3-11(16)13(12)14(19)15(18)20/h2-4,10H,5-9H2,1H3/p+1