1-(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)-1,3,6-trimethyl-5-piperidin-4-yl-quinazolin-1-ium-2,4-dione

Systemtic Name: 1-(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)-1,3,6-trimethyl-5-piperidin-4-yl-quinazolin-1-ium-2,4-dione Openeye Name: 1-(2-chloro-6,7-dimethoxy-quinazolin-4-yl)-1,3,6-trimethyl-5-(4-piperidyl)quinazolin-1-ium-2,4-dione CAS Name: 1-(2-chloro-6,7-dimethoxy-4-quinazolinyl)-1,3,6-trimethyl-5-(4-piperidinyl)quinazolin-1-ium-2,4-dione IUPAC Name: 1-(2-chloro-6,7-dimethoxyquinazolin-4-yl)-1,3,6-trimethyl-5-piperidin-4-ylquinazolin-1-ium-2,4-dione Traditional Name: 1-(2-chloro-6,7-dimethoxy-quinazolin-4-yl)-1,3,6-trimethyl-5-(4-piperidyl)quinazolin-1-ium-2,4-quinone Formula: C26H29ClN5O4+ MolecularWeight: 510.99256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)[N+](C(=O)N(C2=O)C)(C)C3=NC(=NC4=CC(=C(C=C43)OC)OC)Cl)C5CCNCC5

Isomeric SMILES

CC1=C(C2=C(C=C1)[N+](C(=O)N(C2=O)C)(C)C3=NC(=NC4=CC(=C(C=C43)OC)OC)Cl)C5CCNCC5

InChI

InChI=1S/C26H29ClN5O4/c1-14-6-7-18-22(21(14)15-8-10-28-11-9-15)24(33)31(2)26(34)32(18,3)23-16-12-19(35-4)20(36-5)13-17(16)29-25(27)30-23/h6-7,12-13,15,28H,8-11H2,1-5H3/q+1