5-bromanyl-3-(4-methoxyphenyl)imino-1-[(4-methylpiperidin-1-ium-1-yl)methyl]indol-2-one

Systemtic Name: 5-bromanyl-3-(4-methoxyphenyl)imino-1-[(4-methylpiperidin-1-ium-1-yl)methyl]indol-2-one Openeye Name: 5-bromo-3-(4-methoxyphenyl)imino-1-[(4-methylpiperidin-1-ium-1-yl)methyl]indolin-2-one CAS Name: 5-bromo-3-(4-methoxyphenyl)imino-1-[(4-methyl-1-piperidin-1-iumyl)methyl]-2-indolone IUPAC Name: 5-bromo-3-(4-methoxyphenyl)imino-1-[(4-methylpiperidin-1-ium-1-yl)methyl]indol-2-one Traditional Name: 5-bromo-3-(4-methoxyphenyl)imino-1-[(4-methylpiperidin-1-ium-1-yl)methyl]oxindole Formula: C22H25BrN3O2+ MolecularWeight: 443.3568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CN2C3=C(C=C(C=C3)Br)C(=NC4=CC=C(C=C4)OC)C2=O

Isomeric SMILES

CC1CC[NH+](CC1)CN2C3=C(C=C(C=C3)Br)C(=NC4=CC=C(C=C4)OC)C2=O

InChI

InChI=1S/C22H24BrN3O2/c1-15-9-11-25(12-10-15)14-26-20-8-3-16(23)13-19(20)21(22(26)27)24-17-4-6-18(28-2)7-5-17/h3-8,13,15H,9-12,14H2,1-2H3/p+1