methyl 2-[methyl-[2-[6-nitro-4-(1-phenylethylamino)quinazolin-7-yl]oxyethyl]amino]ethanoate

Systemtic Name: methyl 2-[methyl-[2-[6-nitro-4-(1-phenylethylamino)quinazolin-7-yl]oxyethyl]amino]ethanoate Openeye Name: methyl 2-[methyl-[2-[6-nitro-4-(1-phenylethylamino)quinazolin-7-yl]oxyethyl]amino]acetate CAS Name: 2-[methyl-[2-[[6-nitro-4-(1-phenylethylamino)-7-quinazolinyl]oxy]ethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[methyl-[2-[6-nitro-4-(1-phenylethylamino)quinazolin-7-yl]oxyethyl]amino]acetate Traditional Name: 2-[methyl-[2-[6-nitro-4-(1-phenylethylamino)quinazolin-7-yl]oxyethyl]amino]acetic acid methyl ester Formula: C22H25N5O5 MolecularWeight: 439.4644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N5O5/c1-15(16-7-5-4-6-8-16)25-22-17-11-19(27(29)30)20(12-18(17)23-14-24-22)32-10-9-26(2)13-21(28)31-3/h4-8,11-12,14-15H,9-10,13H2,1-3H3,(H,23,24,25)