1-(6,7-diethoxy-2-morpholin-4-yl-quinazolin-4-yl)-1-methyl-3-piperidin-4-yl-quinazolin-1-ium-2,4-dione

Systemtic Name: 1-(6,7-diethoxy-2-morpholin-4-yl-quinazolin-4-yl)-1-methyl-3-piperidin-4-yl-quinazolin-1-ium-2,4-dione Openeye Name: 1-(6,7-diethoxy-2-morpholino-quinazolin-4-yl)-1-methyl-3-(4-piperidyl)quinazolin-1-ium-2,4-dione CAS Name: 1-[6,7-diethoxy-2-(4-morpholinyl)-4-quinazolinyl]-1-methyl-3-(4-piperidinyl)quinazolin-1-ium-2,4-dione IUPAC Name: 1-(6,7-diethoxy-2-morpholin-4-ylquinazolin-4-yl)-1-methyl-3-piperidin-4-ylquinazolin-1-ium-2,4-dione Traditional Name: 1-(6,7-diethoxy-2-morpholino-quinazolin-4-yl)-1-methyl-3-(4-piperidyl)quinazolin-1-ium-2,4-quinone Formula: C30H37N6O5+ MolecularWeight: 561.65198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=NC(=N2)N3CCOCC3)[N+]4(C5=CC=CC=C5C(=O)N(C4=O)C6CCNCC6)C)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=NC(=N2)N3CCOCC3)[N+]4(C5=CC=CC=C5C(=O)N(C4=O)C6CCNCC6)C)OCC

InChI

InChI=1S/C30H37N6O5/c1-4-40-25-18-22-23(19-26(25)41-5-2)32-29(34-14-16-39-17-15-34)33-27(22)36(3)24-9-7-6-8-21(24)28(37)35(30(36)38)20-10-12-31-13-11-20/h6-9,18-20,31H,4-5,10-17H2,1-3H3/q+1