1-(6,7-dimethoxyquinazolin-4-yl)-1-ethyl-6-methoxy-3-piperidin-4-yl-quinazolin-1-ium-2,4-dione

Systemtic Name: 1-(6,7-dimethoxyquinazolin-4-yl)-1-ethyl-6-methoxy-3-piperidin-4-yl-quinazolin-1-ium-2,4-dione Openeye Name: 1-(6,7-dimethoxyquinazolin-4-yl)-1-ethyl-6-methoxy-3-(4-piperidyl)quinazolin-1-ium-2,4-dione CAS Name: 1-(6,7-dimethoxy-4-quinazolinyl)-1-ethyl-6-methoxy-3-(4-piperidinyl)quinazolin-1-ium-2,4-dione IUPAC Name: 1-(6,7-dimethoxyquinazolin-4-yl)-1-ethyl-6-methoxy-3-piperidin-4-ylquinazolin-1-ium-2,4-dione Traditional Name: 1-(6,7-dimethoxyquinazolin-4-yl)-1-ethyl-6-methoxy-3-(4-piperidyl)quinazolin-1-ium-2,4-quinone Formula: C26H30N5O5+ MolecularWeight: 492.5469

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C2=C(C=C(C=C2)OC)C(=O)N(C1=O)C3CCNCC3)C4=NC=NC5=CC(=C(C=C54)OC)OC

Isomeric SMILES

CC[N+]1(C2=C(C=C(C=C2)OC)C(=O)N(C1=O)C3CCNCC3)C4=NC=NC5=CC(=C(C=C54)OC)OC

InChI

InChI=1S/C26H30N5O5/c1-5-31(24-18-13-22(35-3)23(36-4)14-20(18)28-15-29-24)21-7-6-17(34-2)12-19(21)25(32)30(26(31)33)16-8-10-27-11-9-16/h6-7,12-16,27H,5,8-11H2,1-4H3/q+1