2-[1-(cyclohexa-1,3-dien-1-ylmethyl)-1-methyl-piperidin-1-ium-4-yl]-4-methyl-3H-pyrrolo[1,2-a]indole

Systemtic Name: 2-[1-(cyclohexa-1,3-dien-1-ylmethyl)-1-methyl-piperidin-1-ium-4-yl]-4-methyl-3H-pyrrolo[1,2-a]indole Openeye Name: 2-[1-(cyclohexa-1,3-dien-1-ylmethyl)-1-methyl-piperidin-1-ium-4-yl]-4-methyl-3H-pyrrolo[1,2-a]indole CAS Name: 2-[1-(1-cyclohexa-1,3-dienylmethyl)-1-methyl-4-piperidin-1-iumyl]-4-methyl-3H-pyrrolo[1,2-a]indole IUPAC Name: 2-[1-(cyclohexa-1,3-dien-1-ylmethyl)-1-methylpiperidin-1-ium-4-yl]-4-methyl-3H-pyrrolo[1,2-a]indole Traditional Name: 2-[1-(cyclohexa-1,3-dien-1-ylmethyl)-1-methyl-piperidin-1-ium-4-yl]-4-methyl-3H-pyrrol[1,2-a]indole Formula: C25H31N2+ MolecularWeight: 359.52704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CC(=CN2C3=CC=CC=C13)C4CC[N+](CC4)(C)CC5=CC=CCC5

Isomeric SMILES

CC1=C2CC(=CN2C3=CC=CC=C13)C4CC[N+](CC4)(C)CC5=CC=CCC5

InChI

InChI=1S/C25H31N2/c1-19-23-10-6-7-11-24(23)26-17-22(16-25(19)26)21-12-14-27(2,15-13-21)18-20-8-4-3-5-9-20/h3-4,6-8,10-11,17,21H,5,9,12-16,18H2,1-2H3/q+1