2-[4-[1,6-dimethyl-2,4-bis(oxidanylidene)-3-piperidin-4-yl-quinazolin-1-ium-1-yl]-6-methoxy-quinazolin-7-yl]oxyethanoic acid

Systemtic Name: 2-[4-[1,6-dimethyl-2,4-bis(oxidanylidene)-3-piperidin-4-yl-quinazolin-1-ium-1-yl]-6-methoxy-quinazolin-7-yl]oxyethanoic acid Openeye Name: 2-[4-[1,6-dimethyl-2,4-dioxo-3-(4-piperidyl)quinazolin-1-ium-1-yl]-6-methoxy-quinazolin-7-yl]oxyacetic acid CAS Name: 2-[[4-[1,6-dimethyl-2,4-dioxo-3-(4-piperidinyl)-1-quinazolin-1-iumyl]-6-methoxy-7-quinazolinyl]oxy]acetic acid IUPAC Name: 2-[4-(1,6-dimethyl-2,4-dioxo-3-piperidin-4-ylquinazolin-1-ium-1-yl)-6-methoxyquinazolin-7-yl]oxyacetic acid Traditional Name: 2-[4-[2,4-diketo-1,6-dimethyl-3-(4-piperidyl)quinazolin-1-ium-1-yl]-6-methoxy-quinazolin-7-yl]oxyacetic acid Formula: C26H28N5O6+ MolecularWeight: 506.53042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[N+](C(=O)N(C2=O)C3CCNCC3)(C)C4=NC=NC5=CC(=C(C=C54)OC)OCC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)[N+](C(=O)N(C2=O)C3CCNCC3)(C)C4=NC=NC5=CC(=C(C=C54)OC)OCC(=O)O

InChI

InChI=1S/C26H27N5O6/c1-15-4-5-20-18(10-15)25(34)30(16-6-8-27-9-7-16)26(35)31(20,2)24-17-11-21(36-3)22(37-13-23(32)33)12-19(17)28-14-29-24/h4-5,10-12,14,16,27H,6-9,13H2,1-3H3/p+1