1-butyl-3,4-dihydro-2H-pyrido[3,4-b]indol-9-ium

Systemtic Name: 1-butyl-3,4-dihydro-2H-pyrido[3,4-b]indol-9-ium Openeye Name: 1-butyl-3,4-dihydro-2H-pyrido[3,4-b]indol-9-ium CAS Name: 1-butyl-3,4-dihydro-2H-pyrido[3,4-b]indol-9-ium IUPAC Name: 1-butyl-3,4-dihydro-2H-pyrido[3,4-b]indol-9-ium Traditional Name: 1-butyl-3,4-dihydro-2H-$b-carbolin-9-ium Formula: C15H19N2+ MolecularWeight: 227.32476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C(=C3C=CC=CC3=[NH+]2)CCN1

Isomeric SMILES

CCCCC1=C2C(=C3C=CC=CC3=[NH+]2)CCN1

InChI

InChI=1S/C15H18N2/c1-2-3-7-14-15-12(9-10-16-14)11-6-4-5-8-13(11)17-15/h4-6,8,16H,2-3,7,9-10H2,1H3/p+1