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

Systemtic Name: 2-methoxyethyl-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: 2-methoxyethyl-[2-(4-methylanilino)-2-oxo-ethyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: 2-methoxyethyl-[2-(4-methylanilino)-2-oxoethyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: 2-methoxyethyl-[2-(4-methylanilino)-2-oxoethyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: [2-keto-2-(p-toluidino)ethyl]-[(4-keto-1H-quinazolin-2-yl)methyl]-(2-methoxyethyl)ammonium Formula: C21H25N4O3+ MolecularWeight: 381.4482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C[NH+](CCOC)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[NH+](CCOC)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C21H24N4O3/c1-15-7-9-16(10-8-15)22-20(26)14-25(11-12-28-2)13-19-23-18-6-4-3-5-17(18)21(27)24-19/h3-10H,11-14H2,1-2H3,(H,22,26)(H,23,24,27)/p+1