4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]benzamide Openeye Name: 4-(2-methyl-4-oxo-quinazolin-3-yl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]benzamide CAS Name: 4-(2-methyl-4-oxo-3-quinazolinyl)-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 4-(2-methyl-4-oxoquinazolin-3-yl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]benzamide Traditional Name: 4-(4-keto-2-methyl-quinazolin-3-yl)-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]benzamide Formula: C28H29N4O3+ MolecularWeight: 469.55486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)NCC4=CC=CC=C4C[NH+]5CCOCC5

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)NCC4=CC=CC=C4C[NH+]5CCOCC5

InChI

InChI=1S/C28H28N4O3/c1-20-30-26-9-5-4-8-25(26)28(34)32(20)24-12-10-21(11-13-24)27(33)29-18-22-6-2-3-7-23(22)19-31-14-16-35-17-15-31/h2-13H,14-19H2,1H3,(H,29,33)/p+1