ethyl 2-(1-propyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)ethanoate

Systemtic Name: ethyl 2-(1-propyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)ethanoate Openeye Name: ethyl 2-(1-propyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)acetate CAS Name: 2-(1-propyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(1-propyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)acetate Traditional Name: 2-(1-propyl-9H-$b-carbolin-2-ium-2-yl)acetic acid ethyl ester Formula: C18H21N2O2+ MolecularWeight: 297.37154

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=[N+](C=CC2=C1NC3=CC=CC=C23)CC(=O)OCC

Isomeric SMILES

CCCC1=[N+](C=CC2=C1NC3=CC=CC=C23)CC(=O)OCC

InChI

InChI=1S/C18H20N2O2/c1-3-7-16-18-14(13-8-5-6-9-15(13)19-18)10-11-20(16)12-17(21)22-4-2/h5-6,8-11H,3-4,7,12H2,1-2H3/p+1