2-chloranyl-5-nitro-N-prop-2-enyl-quinazolin-4-amine

Systemtic Name: 2-chloranyl-5-nitro-N-prop-2-enyl-quinazolin-4-amine Openeye Name: N-allyl-2-chloro-5-nitro-quinazolin-4-amine CAS Name: 2-chloro-5-nitro-N-prop-2-enyl-4-quinazolinamine IUPAC Name: 2-chloro-5-nitro-N-prop-2-enylquinazolin-4-amine Traditional Name: allyl-(2-chloro-5-nitro-quinazolin-4-yl)amine Formula: C11H9ClN4O2 MolecularWeight: 264.66776

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC(=NC2=C1C(=CC=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C=CCNC1=NC(=NC2=C1C(=CC=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H9ClN4O2/c1-2-6-13-10-9-7(14-11(12)15-10)4-3-5-8(9)16(17)18/h2-5H,1,6H2,(H,13,14,15)