2-methoxyethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-[[4-(phenylcarbamoyl)phenyl]methyl]azanium

Systemtic Name: 2-methoxyethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-[[4-(phenylcarbamoyl)phenyl]methyl]azanium Openeye Name: 2-methoxyethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[[4-(phenylcarbamoyl)phenyl]methyl]ammonium CAS Name: [4-[anilino(oxo)methyl]phenyl]methyl-(2-methoxyethyl)-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: 2-methoxyethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[[4-(phenylcarbamoyl)phenyl]methyl]azanium Traditional Name: (4-keto-1H-quinazolin-2-yl)methyl-(2-methoxyethyl)-[4-(phenylcarbamoyl)benzyl]ammonium Formula: C26H27N4O3+ MolecularWeight: 443.51758

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH+](CC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

COCC[NH+](CC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C26H26N4O3/c1-33-16-15-30(18-24-28-23-10-6-5-9-22(23)26(32)29-24)17-19-11-13-20(14-12-19)25(31)27-21-7-3-2-4-8-21/h2-14H,15-18H2,1H3,(H,27,31)(H,28,29,32)/p+1