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

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-[(4-dimethylaminophenyl)methyl]-ethyl-azanium Openeye Name: [3-(2-amino-2-oxo-ethyl)-4-oxo-quinazolin-2-yl]methyl-[(4-dimethylaminophenyl)methyl]-ethyl-ammonium CAS Name: [3-(2-amino-2-oxoethyl)-4-oxo-2-quinazolinyl]methyl-[(4-dimethylaminophenyl)methyl]-ethylammonium IUPAC Name: [3-(2-amino-2-oxoethyl)-4-oxoquinazolin-2-yl]methyl-[(4-dimethylaminophenyl)methyl]-ethylazanium Traditional Name: [3-(2-amino-2-keto-ethyl)-4-keto-quinazolin-2-yl]methyl-[4-(dimethylamino)benzyl]-ethyl-ammonium Formula: C22H28N5O2+ MolecularWeight: 394.49002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N5O2/c1-4-26(13-16-9-11-17(12-10-16)25(2)3)15-21-24-19-8-6-5-7-18(19)22(29)27(21)14-20(23)28/h5-12H,4,13-15H2,1-3H3,(H2,23,28)/p+1