N2-(2-azanylethyl)-6-nitro-N4-prop-2-enyl-quinazoline-2,4-diamine

Systemtic Name: N2-(2-azanylethyl)-6-nitro-N4-prop-2-enyl-quinazoline-2,4-diamine Openeye Name: N4-allyl-N2-(2-aminoethyl)-6-nitro-quinazoline-2,4-diamine CAS Name: N2-(2-aminoethyl)-6-nitro-N4-prop-2-enylquinazoline-2,4-diamine IUPAC Name: 2-N-(2-aminoethyl)-6-nitro-4-N-prop-2-enylquinazoline-2,4-diamine Traditional Name: allyl-[2-(2-aminoethylamino)-6-nitro-quinazolin-4-yl]amine Formula: C13H16N6O2 MolecularWeight: 288.30514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N6O2/c1-2-6-15-12-10-8-9(19(20)21)3-4-11(10)17-13(18-12)16-7-5-14/h2-4,8H,1,5-7,14H2,(H2,15,16,17,18)