N2-butyl-N4-(3-methylbut-2-enyl)-6-nitro-quinazoline-2,4-diamine

Systemtic Name: N2-butyl-N4-(3-methylbut-2-enyl)-6-nitro-quinazoline-2,4-diamine Openeye Name: N2-butyl-N4-(3-methylbut-2-enyl)-6-nitro-quinazoline-2,4-diamine CAS Name: N2-butyl-N4-(3-methylbut-2-enyl)-6-nitroquinazoline-2,4-diamine IUPAC Name: 2-N-butyl-4-N-(3-methylbut-2-enyl)-6-nitroquinazoline-2,4-diamine Traditional Name: butyl-[4-(3-methylbut-2-enylamino)-6-nitro-quinazolin-2-yl]amine Formula: C17H23N5O2 MolecularWeight: 329.39682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)NCC=C(C)C

Isomeric SMILES

CCCCNC1=NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)NCC=C(C)C

InChI

InChI=1S/C17H23N5O2/c1-4-5-9-19-17-20-15-7-6-13(22(23)24)11-14(15)16(21-17)18-10-8-12(2)3/h6-8,11H,4-5,9-10H2,1-3H3,(H2,18,19,20,21)