N4-cycloheptyl-5-nitro-N6-prop-2-enyl-pyrimidine-4,6-diamine

Systemtic Name: N4-cycloheptyl-5-nitro-N6-prop-2-enyl-pyrimidine-4,6-diamine Openeye Name: N6-allyl-N4-cycloheptyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-cycloheptyl-5-nitro-N6-prop-2-enylpyrimidine-4,6-diamine IUPAC Name: 4-N-cycloheptyl-5-nitro-6-N-prop-2-enylpyrimidine-4,6-diamine Traditional Name: allyl-[6-(cycloheptylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C14H21N5O2 MolecularWeight: 291.34884

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC=NC(=C1[N+](=O)[O-])NC2CCCCCC2

Isomeric SMILES

C=CCNC1=NC=NC(=C1[N+](=O)[O-])NC2CCCCCC2

InChI

InChI=1S/C14H21N5O2/c1-2-9-15-13-12(19(20)21)14(17-10-16-13)18-11-7-5-3-4-6-8-11/h2,10-11H,1,3-9H2,(H2,15,16,17,18)