2-(2-diethylaminoethylamino)-7-nitro-3-prop-2-enyl-quinazolin-4-one chloride

Systemtic Name: 2-(2-diethylaminoethylamino)-7-nitro-3-prop-2-enyl-quinazolin-4-one chloride Openeye Name: 3-allyl-2-(2-diethylaminoethylamino)-7-nitro-quinazolin-4-one chloride CAS Name: 2-(2-diethylaminoethylamino)-7-nitro-3-prop-2-enyl-4-quinazolinone chloride IUPAC Name: 2-(2-diethylaminoethylamino)-7-nitro-3-prop-2-enylquinazolin-4-one chloride Traditional Name: 3-allyl-2-(2-diethylaminoethylamino)-7-nitro-quinazolin-4-one chloride Formula: C17H23ClN5O3- MolecularWeight: 380.84922

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=NC2=C(C=CC(=C2)[N+](=O)[O-])C(=O)N1CC=C.[Cl-]

Isomeric SMILES

CCN(CC)CCNC1=NC2=C(C=CC(=C2)[N+](=O)[O-])C(=O)N1CC=C.[Cl-]

InChI

InChI=1S/C17H23N5O3.ClH/c1-4-10-21-16(23)14-8-7-13(22(24)25)12-15(14)19-17(21)18-9-11-20(5-2)6-3;/h4,7-8,12H,1,5-6,9-11H2,2-3H3,(H,18,19);1H/p-1