1-methyl-4-[(2S)-1-methylpyrrolidin-1-ium-2-yl]-9H-pyrido[3,4-b]indole

Systemtic Name: 1-methyl-4-[(2S)-1-methylpyrrolidin-1-ium-2-yl]-9H-pyrido[3,4-b]indole Openeye Name: 1-methyl-4-[(2S)-1-methylpyrrolidin-1-ium-2-yl]-9H-pyrido[3,4-b]indole CAS Name: 1-methyl-4-[(2S)-1-methyl-2-pyrrolidin-1-iumyl]-9H-pyrido[3,4-b]indole IUPAC Name: 1-methyl-4-[(2S)-1-methylpyrrolidin-1-ium-2-yl]-9H-pyrido[3,4-b]indole Traditional Name: 1-methyl-4-[(2S)-1-methylpyrrolidin-1-ium-2-yl]-9H-$b-carboline Formula: C17H20N3+ MolecularWeight: 266.3608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C2=C1NC3=CC=CC=C32)C4CCC[NH+]4C

Isomeric SMILES

CC1=NC=C(C2=C1NC3=CC=CC=C32)[C@@H]4CCC[NH+]4C

InChI

InChI=1S/C17H19N3/c1-11-17-16(12-6-3-4-7-14(12)19-17)13(10-18-11)15-8-5-9-20(15)2/h3-4,6-7,10,15,19H,5,8-9H2,1-2H3/p+1/t15-/m0/s1