N-[3-[ethyl(phenyl)amino]propyl]-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide

Systemtic Name: N-[3-[ethyl(phenyl)amino]propyl]-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Openeye Name: N-[3-(N-ethylanilino)propyl]-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide CAS Name: N-[3-(N-ethylanilino)propyl]-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide IUPAC Name: N-[3-(N-ethylanilino)propyl]-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Traditional Name: N-[3-(N-ethylanilino)propyl]-4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Formula: C20H23N4O2+ MolecularWeight: 351.42222

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCNC(=O)C1=CNC2=CC=CC=[N+]2C1=O)C3=CC=CC=C3

Isomeric SMILES

CCN(CCCNC(=O)C1=CNC2=CC=CC=[N+]2C1=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O2/c1-2-23(16-9-4-3-5-10-16)13-8-12-21-19(25)17-15-22-18-11-6-7-14-24(18)20(17)26/h3-7,9-11,14-15H,2,8,12-13H2,1H3,(H,21,25)/p+1