N7-ethyl-N2-heptan-2-yl-6-nitro-quinazoline-2,7-diamine

Systemtic Name: N7-ethyl-N2-heptan-2-yl-6-nitro-quinazoline-2,7-diamine Openeye Name: N7-ethyl-N2-(1-methylhexyl)-6-nitro-quinazoline-2,7-diamine CAS Name: N7-ethyl-N2-heptan-2-yl-6-nitroquinazoline-2,7-diamine IUPAC Name: 7-N-ethyl-2-N-heptan-2-yl-6-nitroquinazoline-2,7-diamine Traditional Name: ethyl-[2-(1-methylhexylamino)-6-nitro-quinazolin-7-yl]amine Formula: C17H25N5O2 MolecularWeight: 331.4127

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC1=NC2=CC(=C(C=C2C=N1)[N+](=O)[O-])NCC

Isomeric SMILES

CCCCCC(C)NC1=NC2=CC(=C(C=C2C=N1)[N+](=O)[O-])NCC

InChI

InChI=1S/C17H25N5O2/c1-4-6-7-8-12(3)20-17-19-11-13-9-16(22(23)24)15(18-5-2)10-14(13)21-17/h9-12,18H,4-8H2,1-3H3,(H,19,20,21)