4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 4-(2-methyl-4-oxo-quinazolin-3-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 4-(2-methyl-4-oxo-3-quinazolinyl)-N-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 4-(2-methyl-4-oxoquinazolin-3-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 4-(4-keto-2-methyl-quinazolin-3-yl)-N-[4-(pyrrolidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C28H29N4O2+ MolecularWeight: 453.55546

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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=C(C=C4)C[NH+]5CCCC5

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)NCC4=CC=C(C=C4)C[NH+]5CCCC5

InChI

InChI=1S/C28H28N4O2/c1-20-30-26-7-3-2-6-25(26)28(34)32(20)24-14-12-23(13-15-24)27(33)29-18-21-8-10-22(11-9-21)19-31-16-4-5-17-31/h2-3,6-15H,4-5,16-19H2,1H3,(H,29,33)/p+1