[5-chloranyl-2,3-bis(oxidanylidene)indol-1-yl]methyl-methyl-[(4-piperidin-1-ylphenyl)methyl]azanium

Systemtic Name: [5-chloranyl-2,3-bis(oxidanylidene)indol-1-yl]methyl-methyl-[(4-piperidin-1-ylphenyl)methyl]azanium Openeye Name: (5-chloro-2,3-dioxo-indolin-1-yl)methyl-methyl-[[4-(1-piperidyl)phenyl]methyl]ammonium CAS Name: (5-chloro-2,3-dioxo-1-indolyl)methyl-methyl-[[4-(1-piperidinyl)phenyl]methyl]ammonium IUPAC Name: (5-chloro-2,3-dioxoindol-1-yl)methyl-methyl-[(4-piperidin-1-ylphenyl)methyl]azanium Traditional Name: (5-chloro-2,3-diketo-indolin-1-yl)methyl-methyl-(4-piperidinobenzyl)ammonium Formula: C22H25ClN3O2+ MolecularWeight: 398.9058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)N2CCCCC2)CN3C4=C(C=C(C=C4)Cl)C(=O)C3=O

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)N2CCCCC2)CN3C4=C(C=C(C=C4)Cl)C(=O)C3=O

InChI

InChI=1S/C22H24ClN3O2/c1-24(14-16-5-8-18(9-6-16)25-11-3-2-4-12-25)15-26-20-10-7-17(23)13-19(20)21(27)22(26)28/h5-10,13H,2-4,11-12,14-15H2,1H3/p+1