1-[2-(dipropylamino)-6,7-diethoxy-quinazolin-4-yl]-1,6-dimethyl-3-piperidin-4-yl-quinazolin-1-ium-2,4-dione hydrochloride

Systemtic Name: 1-[2-(dipropylamino)-6,7-diethoxy-quinazolin-4-yl]-1,6-dimethyl-3-piperidin-4-yl-quinazolin-1-ium-2,4-dione hydrochloride Openeye Name: 1-[2-(dipropylamino)-6,7-diethoxy-quinazolin-4-yl]-1,6-dimethyl-3-(4-piperidyl)quinazolin-1-ium-2,4-dione hydrochloride CAS Name: 1-[2-(dipropylamino)-6,7-diethoxy-4-quinazolinyl]-1,6-dimethyl-3-(4-piperidinyl)quinazolin-1-ium-2,4-dione hydrochloride IUPAC Name: 1-[2-(dipropylamino)-6,7-diethoxyquinazolin-4-yl]-1,6-dimethyl-3-piperidin-4-ylquinazolin-1-ium-2,4-dione hydrochloride Traditional Name: 1-[2-(dipropylamino)-6,7-diethoxy-quinazolin-4-yl]-1,6-dimethyl-3-(4-piperidyl)quinazolin-1-ium-2,4-quinone hydrochloride Formula: C33H46ClN6O4+ MolecularWeight: 626.20914

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=NC2=CC(=C(C=C2C(=N1)[N+]3(C4=C(C=C(C=C4)C)C(=O)N(C3=O)C5CCNCC5)C)OCC)OCC.Cl

Isomeric SMILES

CCCN(CCC)C1=NC2=CC(=C(C=C2C(=N1)[N+]3(C4=C(C=C(C=C4)C)C(=O)N(C3=O)C5CCNCC5)C)OCC)OCC.Cl

InChI

InChI=1S/C33H45N6O4.ClH/c1-7-17-37(18-8-2)32-35-26-21-29(43-10-4)28(42-9-3)20-24(26)30(36-32)39(6)27-12-11-22(5)19-25(27)31(40)38(33(39)41)23-13-15-34-16-14-23;/h11-12,19-21,23,34H,7-10,13-18H2,1-6H3;1H/q+1;