N-(2-hydroxyphenyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-(2-hydroxyphenyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-(2-hydroxyphenyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-(2-hydroxyphenyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-(2-hydroxyphenyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-(2-hydroxyphenyl)-1-[(4-keto-1H-quinazolin-2-yl)methyl]piperidin-1-ium-4-carboxamide Formula: C21H23N4O3+ MolecularWeight: 379.43232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2O)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2O)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C21H22N4O3/c26-18-8-4-3-7-17(18)23-20(27)14-9-11-25(12-10-14)13-19-22-16-6-2-1-5-15(16)21(28)24-19/h1-8,14,26H,9-13H2,(H,23,27)(H,22,24,28)/p+1