4-[2-[2-(morpholin-4-ium-4-ylmethyl)-4-oxidanylidene-quinazolin-3-yl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[2-(morpholin-4-ium-4-ylmethyl)-4-oxidanylidene-quinazolin-3-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-[2-(morpholin-4-ium-4-ylmethyl)-4-oxo-quinazolin-3-yl]acetyl]amino]benzamide CAS Name: 4-[[2-[2-(4-morpholin-4-iumylmethyl)-4-oxo-3-quinazolinyl]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[2-(morpholin-4-ium-4-ylmethyl)-4-oxoquinazolin-3-yl]acetyl]amino]benzamide Traditional Name: 4-[[2-[4-keto-2-(morpholin-4-ium-4-ylmethyl)quinazolin-3-yl]acetyl]amino]benzamide Formula: C22H24N5O4+ MolecularWeight: 422.45706

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=NC3=CC=CC=C3C(=O)N2CC(=O)NC4=CC=C(C=C4)C(=O)N

Isomeric SMILES

C1COCC[NH+]1CC2=NC3=CC=CC=C3C(=O)N2CC(=O)NC4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C22H23N5O4/c23-21(29)15-5-7-16(8-6-15)24-20(28)14-27-19(13-26-9-11-31-12-10-26)25-18-4-2-1-3-17(18)22(27)30/h1-8H,9-14H2,(H2,23,29)(H,24,28)/p+1