3-[1-(6,7-diethoxy-2-morpholin-4-yl-quinazolin-4-yl)piperidin-4-yl]-1-methyl-6-nitro-quinazoline-2,4-dione

Systemtic Name: 3-[1-(6,7-diethoxy-2-morpholin-4-yl-quinazolin-4-yl)piperidin-4-yl]-1-methyl-6-nitro-quinazoline-2,4-dione Openeye Name: 3-[1-(6,7-diethoxy-2-morpholino-quinazolin-4-yl)-4-piperidyl]-1-methyl-6-nitro-quinazoline-2,4-dione CAS Name: 3-[1-[6,7-diethoxy-2-(4-morpholinyl)-4-quinazolinyl]-4-piperidinyl]-1-methyl-6-nitroquinazoline-2,4-dione IUPAC Name: 3-[1-(6,7-diethoxy-2-morpholin-4-ylquinazolin-4-yl)piperidin-4-yl]-1-methyl-6-nitroquinazoline-2,4-dione Traditional Name: 3-[1-(6,7-diethoxy-2-morpholino-quinazolin-4-yl)-4-piperidyl]-1-methyl-6-nitro-quinazoline-2,4-quinone Formula: C30H35N7O7 MolecularWeight: 605.6416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=NC(=N2)N3CCOCC3)N4CCC(CC4)N5C(=O)C6=C(C=CC(=C6)[N+](=O)[O-])N(C5=O)C)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=NC(=N2)N3CCOCC3)N4CCC(CC4)N5C(=O)C6=C(C=CC(=C6)[N+](=O)[O-])N(C5=O)C)OCC

InChI

InChI=1S/C30H35N7O7/c1-4-43-25-17-21-23(18-26(25)44-5-2)31-29(35-12-14-42-15-13-35)32-27(21)34-10-8-19(9-11-34)36-28(38)22-16-20(37(40)41)6-7-24(22)33(3)30(36)39/h6-7,16-19H,4-5,8-15H2,1-3H3