N-(4-methylphenyl)-2-[4-[2-[(4-oxidanylidene-1H-quinazolin-2-yl)methoxy]ethanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-methylphenyl)-2-[4-[2-[(4-oxidanylidene-1H-quinazolin-2-yl)methoxy]ethanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-[2-[(4-oxo-1H-quinazolin-2-yl)methoxy]acetyl]piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-[4-[1-oxo-2-[(4-oxo-1H-quinazolin-2-yl)methoxy]ethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-methylphenyl)-2-[4-[2-[(4-oxo-1H-quinazolin-2-yl)methoxy]acetyl]piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-[2-[(4-keto-1H-quinazolin-2-yl)methoxy]acetyl]piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide Formula: C24H28N5O4+ MolecularWeight: 450.51022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)COCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)COCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C24H27N5O4/c1-17-6-8-18(9-7-17)25-22(30)14-28-10-12-29(13-11-28)23(31)16-33-15-21-26-20-5-3-2-4-19(20)24(32)27-21/h2-9H,10-16H2,1H3,(H,25,30)(H,26,27,32)/p+1