2-chloranylprop-2-enyl-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-ethyl-azanium

Systemtic Name: 2-chloranylprop-2-enyl-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-ethyl-azanium Openeye Name: 2-chloroallyl-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]-ethyl-ammonium CAS Name: 2-chloroprop-2-enyl-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]-ethylammonium IUPAC Name: 2-chloroprop-2-enyl-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]-ethylazanium Traditional Name: 2-chloroallyl-ethyl-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methyl]ammonium Formula: C16H21ClN3O3+ MolecularWeight: 338.80924

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC)CC(=C)Cl

Isomeric SMILES

CC[NH+](CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC)CC(=C)Cl

InChI

InChI=1S/C16H20ClN3O3/c1-5-20(8-10(2)17)9-15-18-12-7-14(23-4)13(22-3)6-11(12)16(21)19-15/h6-7H,2,5,8-9H2,1,3-4H3,(H,18,19,21)/p+1