N-(2-morpholin-4-ium-4-ylethyl)-2,4-bis(oxidanylidene)-3-phenyl-1H-quinazoline-7-carboxamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-2,4-bis(oxidanylidene)-3-phenyl-1H-quinazoline-7-carboxamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-2,4-dioxo-3-phenyl-1H-quinazoline-7-carboxamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-2,4-dioxo-3-phenyl-1H-quinazoline-7-carboxamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-2,4-dioxo-3-phenyl-1H-quinazoline-7-carboxamide Traditional Name: 2,4-diketo-N-(2-morpholin-4-ium-4-ylethyl)-3-phenyl-1H-quinazoline-7-carboxamide Formula: C21H23N4O4+ MolecularWeight: 395.43172

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=O)N3)C4=CC=CC=C4

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=O)N3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O4/c26-19(22-8-9-24-10-12-29-13-11-24)15-6-7-17-18(14-15)23-21(28)25(20(17)27)16-4-2-1-3-5-16/h1-7,14H,8-13H2,(H,22,26)(H,23,28)/p+1