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

Systemtic Name: 2-[6-nitro-4-(1-phenylethylamino)quinazolin-7-yl]oxyethyl methanesulfonate Openeye Name: 2-[6-nitro-4-(1-phenylethylamino)quinazolin-7-yl]oxyethyl methanesulfonate CAS Name: methanesulfonic acid 2-[[6-nitro-4-(1-phenylethylamino)-7-quinazolinyl]oxy]ethyl ester IUPAC Name: 2-[6-nitro-4-(1-phenylethylamino)quinazolin-7-yl]oxyethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[6-nitro-4-(1-phenylethylamino)quinazolin-7-yl]oxyethyl ester Formula: C19H20N4O6S MolecularWeight: 432.4503

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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-])OCCOS(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C19H20N4O6S/c1-13(14-6-4-3-5-7-14)22-19-15-10-17(23(24)25)18(11-16(15)20-12-21-19)28-8-9-29-30(2,26)27/h3-7,10-13H,8-9H2,1-2H3,(H,20,21,22)