3-[3-(2-oxidanylidene-1H-pyrido[2,3-b]pyrazin-3-yl)indol-1-yl]propylazanium ethanoate

Systemtic Name: 3-[3-(2-oxidanylidene-1H-pyrido[2,3-b]pyrazin-3-yl)indol-1-yl]propylazanium ethanoate Openeye Name: 3-[3-(2-oxo-1H-pyrido[2,3-b]pyrazin-3-yl)indol-1-yl]propylammonium acetate CAS Name: 3-[3-(2-oxo-1H-pyrido[2,3-b]pyrazin-3-yl)-1-indolyl]propylammonium acetate IUPAC Name: 3-[3-(2-oxo-1H-pyrido[2,3-b]pyrazin-3-yl)indol-1-yl]propylazanium acetate Traditional Name: 3-[3-(2-keto-1H-pyrido[2,3-b]pyrazin-3-yl)indol-1-yl]propylammonium acetate Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].C1=CC=C2C(=C1)C(=CN2CCC[NH3+])C3=NC4=C(C=CC=N4)NC3=O

Isomeric SMILES

CC(=O)[O-].C1=CC=C2C(=C1)C(=CN2CCC[NH3+])C3=NC4=C(C=CC=N4)NC3=O

InChI

InChI=1S/C18H17N5O.C2H4O2/c19-8-4-10-23-11-13(12-5-1-2-7-15(12)23)16-18(24)21-14-6-3-9-20-17(14)22-16;1-2(3)4/h1-3,5-7,9,11H,4,8,10,19H2,(H,21,24);1H3,(H,3,4)