3-[2-[2,4-bis(oxidanylidene)quinazolin-1-yl]ethanoylamino]propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-[2-[2,4-bis(oxidanylidene)quinazolin-1-yl]ethanoylamino]propyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-[[2-(2,4-dioxoquinazolin-1-yl)acetyl]amino]propyl]-methyl-ammonium CAS Name: 3-[[2-(2,4-dioxo-1-quinazolinyl)-1-oxoethyl]amino]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[[2-(2,4-dioxoquinazolin-1-yl)acetyl]amino]propyl]-methylazanium Traditional Name: benzyl-[3-[[2-(2,4-diketoquinazolin-1-yl)acetyl]amino]propyl]-methyl-ammonium Formula: C21H25N4O3+ MolecularWeight: 381.4482

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNC(=O)CN1C2=CC=CC=C2C(=O)NC1=O)CC3=CC=CC=C3

Isomeric SMILES

C[NH+](CCCNC(=O)CN1C2=CC=CC=C2C(=O)NC1=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H24N4O3/c1-24(14-16-8-3-2-4-9-16)13-7-12-22-19(26)15-25-18-11-6-5-10-17(18)20(27)23-21(25)28/h2-6,8-11H,7,12-15H2,1H3,(H,22,26)(H,23,27,28)/p+1