2-[6-nitro-4-(1-phenylethylamino)quinazolin-7-yl]oxyethanol

Systemtic Name: 2-[6-nitro-4-(1-phenylethylamino)quinazolin-7-yl]oxyethanol Openeye Name: 2-[6-nitro-4-(1-phenylethylamino)quinazolin-7-yl]oxyethanol CAS Name: 2-[[6-nitro-4-(1-phenylethylamino)-7-quinazolinyl]oxy]ethanol IUPAC Name: 2-[6-nitro-4-(1-phenylethylamino)quinazolin-7-yl]oxyethanol Traditional Name: 2-[6-nitro-4-(1-phenylethylamino)quinazolin-7-yl]oxyethanol Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=NC3=CC(=C(C=C32)[N+](=O)[O-])OCCO

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=NC3=CC(=C(C=C32)[N+](=O)[O-])OCCO

InChI

InChI=1S/C18H18N4O4/c1-12(13-5-3-2-4-6-13)21-18-14-9-16(22(24)25)17(26-8-7-23)10-15(14)19-11-20-18/h2-6,9-12,23H,7-8H2,1H3,(H,19,20,21)