1,6-dimethyl-1-(2-morpholin-4-yl-6,7-dipropoxy-quinazolin-4-yl)-3-piperidin-4-yl-quinazolin-1-ium-2,4-dione hydrochloride

Systemtic Name: 1,6-dimethyl-1-(2-morpholin-4-yl-6,7-dipropoxy-quinazolin-4-yl)-3-piperidin-4-yl-quinazolin-1-ium-2,4-dione hydrochloride Openeye Name: 1,6-dimethyl-1-(2-morpholino-6,7-dipropoxy-quinazolin-4-yl)-3-(4-piperidyl)quinazolin-1-ium-2,4-dione hydrochloride CAS Name: 1,6-dimethyl-1-[2-(4-morpholinyl)-6,7-dipropoxy-4-quinazolinyl]-3-(4-piperidinyl)quinazolin-1-ium-2,4-dione hydrochloride IUPAC Name: 1,6-dimethyl-1-(2-morpholin-4-yl-6,7-dipropoxyquinazolin-4-yl)-3-piperidin-4-ylquinazolin-1-ium-2,4-dione hydrochloride Traditional Name: 1,6-dimethyl-1-(2-morpholino-6,7-dipropoxy-quinazolin-4-yl)-3-(4-piperidyl)quinazolin-1-ium-2,4-quinone hydrochloride Formula: C33H44ClN6O5+ MolecularWeight: 640.19266

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C2C(=C1)C(=NC(=N2)N3CCOCC3)[N+]4(C5=C(C=C(C=C5)C)C(=O)N(C4=O)C6CCNCC6)C)OCCC.Cl

Isomeric SMILES

CCCOC1=C(C=C2C(=C1)C(=NC(=N2)N3CCOCC3)[N+]4(C5=C(C=C(C=C5)C)C(=O)N(C4=O)C6CCNCC6)C)OCCC.Cl

InChI

InChI=1S/C33H43N6O5.ClH/c1-5-15-43-28-20-24-26(21-29(28)44-16-6-2)35-32(37-13-17-42-18-14-37)36-30(24)39(4)27-8-7-22(3)19-25(27)31(40)38(33(39)41)23-9-11-34-12-10-23;/h7-8,19-21,23,34H,5-6,9-18H2,1-4H3;1H/q+1;