3-(2-methyl-9H-pyrido[3,4-b]indol-2-ium-1-yl)propanoic acid

Systemtic Name: 3-(2-methyl-9H-pyrido[3,4-b]indol-2-ium-1-yl)propanoic acid Openeye Name: 3-(2-methyl-9H-pyrido[3,4-b]indol-2-ium-1-yl)propanoic acid CAS Name: 3-(2-methyl-9H-pyrido[3,4-b]indol-2-ium-1-yl)propanoic acid IUPAC Name: 3-(2-methyl-9H-pyrido[3,4-b]indol-2-ium-1-yl)propanoic acid Traditional Name: 3-(2-methyl-9H-$b-carbolin-2-ium-1-yl)propionic acid Formula: C15H15N2O2+ MolecularWeight: 255.2918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C2=C(C=C1)C3=CC=CC=C3N2)CCC(=O)O

Isomeric SMILES

C[N+]1=C(C2=C(C=C1)C3=CC=CC=C3N2)CCC(=O)O

InChI

InChI=1S/C15H14N2O2/c1-17-9-8-11-10-4-2-3-5-12(10)16-15(11)13(17)6-7-14(18)19/h2-5,8-9H,6-7H2,1H3,(H,18,19)/p+1