[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium Openeye Name: (4-allyloxyphenyl)methyl-[[3-(2-amino-2-oxo-ethyl)-4-oxo-quinazolin-2-yl]methyl]-methyl-ammonium CAS Name: [3-(2-amino-2-oxoethyl)-4-oxo-2-quinazolinyl]methyl-methyl-[(4-prop-2-enoxyphenyl)methyl]ammonium IUPAC Name: [3-(2-amino-2-oxoethyl)-4-oxoquinazolin-2-yl]methyl-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium Traditional Name: (4-allyloxybenzyl)-[[3-(2-amino-2-keto-ethyl)-4-keto-quinazolin-2-yl]methyl]-methyl-ammonium Formula: C22H25N4O3+ MolecularWeight: 393.4589

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O3/c1-3-12-29-17-10-8-16(9-11-17)13-25(2)15-21-24-19-7-5-4-6-18(19)22(28)26(21)14-20(23)27/h3-11H,1,12-15H2,2H3,(H2,23,27)/p+1