1-(6-ethoxy-2-morpholin-4-yl-7-oxidanylidene-3H-quinazolin-4-yl)-1,6-dimethyl-3-piperidin-4-yl-quinazolin-1-ium-2,4-dione

Systemtic Name: 1-(6-ethoxy-2-morpholin-4-yl-7-oxidanylidene-3H-quinazolin-4-yl)-1,6-dimethyl-3-piperidin-4-yl-quinazolin-1-ium-2,4-dione Openeye Name: 1-(6-ethoxy-2-morpholino-7-oxo-3H-quinazolin-4-yl)-1,6-dimethyl-3-(4-piperidyl)quinazolin-1-ium-2,4-dione CAS Name: 1-[6-ethoxy-2-(4-morpholinyl)-7-oxo-3H-quinazolin-4-yl]-1,6-dimethyl-3-(4-piperidinyl)quinazolin-1-ium-2,4-dione IUPAC Name: 1-(6-ethoxy-2-morpholin-4-yl-7-oxo-3H-quinazolin-4-yl)-1,6-dimethyl-3-piperidin-4-ylquinazolin-1-ium-2,4-dione Traditional Name: 1-(6-ethoxy-7-keto-2-morpholino-3H-quinazolin-4-yl)-1,6-dimethyl-3-(4-piperidyl)quinazolin-1-ium-2,4-quinone Formula: C29H35N6O5+ MolecularWeight: 547.6254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(NC(=NC2=CC1=O)N3CCOCC3)[N+]4(C5=C(C=C(C=C5)C)C(=O)N(C4=O)C6CCNCC6)C

Isomeric SMILES

CCOC1=CC2=C(NC(=NC2=CC1=O)N3CCOCC3)[N+]4(C5=C(C=C(C=C5)C)C(=O)N(C4=O)C6CCNCC6)C

InChI

InChI=1S/C29H34N6O5/c1-4-40-25-16-20-22(17-24(25)36)31-28(33-11-13-39-14-12-33)32-26(20)35(3)23-6-5-18(2)15-21(23)27(37)34(29(35)38)19-7-9-30-10-8-19/h5-6,15-17,19,30H,4,7-14H2,1-3H3/p+1