[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-[(2-methoxy-5-methyl-phenyl)methyl]-methyl-azanium

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-[(2-methoxy-5-methyl-phenyl)methyl]-methyl-azanium Openeye Name: [3-(2-amino-2-oxo-ethyl)-4-oxo-quinazolin-2-yl]methyl-[(2-methoxy-5-methyl-phenyl)methyl]-methyl-ammonium CAS Name: [3-(2-amino-2-oxoethyl)-4-oxo-2-quinazolinyl]methyl-[(2-methoxy-5-methylphenyl)methyl]-methylammonium IUPAC Name: [3-(2-amino-2-oxoethyl)-4-oxoquinazolin-2-yl]methyl-[(2-methoxy-5-methylphenyl)methyl]-methylazanium Traditional Name: [3-(2-amino-2-keto-ethyl)-4-keto-quinazolin-2-yl]methyl-(2-methoxy-5-methyl-benzyl)-methyl-ammonium Formula: C21H25N4O3+ MolecularWeight: 381.4482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C[NH+](C)CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C[NH+](C)CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N

InChI

InChI=1S/C21H24N4O3/c1-14-8-9-18(28-3)15(10-14)11-24(2)13-20-23-17-7-5-4-6-16(17)21(27)25(20)12-19(22)26/h4-10H,11-13H2,1-3H3,(H2,22,26)/p+1