N-(1-adamantyl)-2-chloranyl-6-nitro-quinazolin-4-amine

Systemtic Name: N-(1-adamantyl)-2-chloranyl-6-nitro-quinazolin-4-amine Openeye Name: N-(1-adamantyl)-2-chloro-6-nitro-quinazolin-4-amine CAS Name: N-(1-adamantyl)-2-chloro-6-nitro-4-quinazolinamine IUPAC Name: N-(1-adamantyl)-2-chloro-6-nitroquinazolin-4-amine Traditional Name: 1-adamantyl-(2-chloro-6-nitro-quinazolin-4-yl)amine Formula: C18H19ClN4O2 MolecularWeight: 358.82206

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC4=NC(=NC5=C4C=C(C=C5)[N+](=O)[O-])Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC4=NC(=NC5=C4C=C(C=C5)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H19ClN4O2/c19-17-20-15-2-1-13(23(24)25)6-14(15)16(21-17)22-18-7-10-3-11(8-18)5-12(4-10)9-18/h1-2,6,10-12H,3-5,7-9H2,(H,20,21,22)