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

Systemtic Name: 2-methoxyethyl-[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: 2-methoxyethyl-[2-oxo-2-(prop-2-ynylamino)ethyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: 2-methoxyethyl-[2-oxo-2-(prop-2-ynylamino)ethyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: 2-methoxyethyl-[2-oxo-2-(prop-2-ynylamino)ethyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: [2-keto-2-(propargylamino)ethyl]-[(4-keto-1H-quinazolin-2-yl)methyl]-(2-methoxyethyl)ammonium Formula: C17H21N4O3+ MolecularWeight: 329.37364

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH+](CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NCC#C

Isomeric SMILES

COCC[NH+](CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NCC#C

InChI

InChI=1S/C17H20N4O3/c1-3-8-18-16(22)12-21(9-10-24-2)11-15-19-14-7-5-4-6-13(14)17(23)20-15/h1,4-7H,8-12H2,2H3,(H,18,22)(H,19,20,23)/p+1