[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-propyl-azanium

Systemtic Name: [2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-propyl-azanium Openeye Name: [2-(2-methylanilino)-2-oxo-ethyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]-propyl-ammonium CAS Name: [2-(2-methylanilino)-2-oxoethyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]-propylammonium IUPAC Name: [2-(2-methylanilino)-2-oxoethyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]-propylazanium Traditional Name: [2-keto-2-(o-toluidino)ethyl]-[(4-keto-1H-quinazolin-2-yl)methyl]-propyl-ammonium Formula: C21H25N4O2+ MolecularWeight: 365.4488

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NC3=CC=CC=C3C

Isomeric SMILES

CCC[NH+](CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C21H24N4O2/c1-3-12-25(14-20(26)23-17-10-6-4-8-15(17)2)13-19-22-18-11-7-5-9-16(18)21(27)24-19/h4-11H,3,12-14H2,1-2H3,(H,23,26)(H,22,24,27)/p+1