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N2-dodecyl-6-nitro-N4-prop-2-enyl-quinazoline-2,4-diamine

N2-dodecyl-6-nitro-N4-prop-2-enyl-quinazoline-2,4-diamine

Systemtic Name:N2-dodecyl-6-nitro-N4-prop-2-enyl-quinazoline-2,4-diamine
Openeye Name:N4-allyl-N2-dodecyl-6-nitro-quinazoline-2,4-diamine
CAS Name:N2-dodecyl-6-nitro-N4-prop-2-enylquinazoline-2,4-diamine
IUPAC Name:2-N-dodecyl-6-nitro-4-N-prop-2-enylquinazoline-2,4-diamine
Traditional Name:allyl-[2-(laurylamino)-6-nitro-quinazolin-4-yl]amine
Formula: C23H35N5O2
MolecularWeight: 413.5563
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC1=NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)NCC=C


Isomeric SMILES

CCCCCCCCCCCCNC1=NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)NCC=C


InChI

InChI=1S/C23H35N5O2/c1-3-5-6-7-8-9-10-11-12-13-17-25-23-26-21-15-14-19(28(29)30)18-20(21)22(27-23)24-16-4-2/h4,14-15,18H,2-3,5-13,16-17H2,1H3,(H2,24,25,26,27)


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