dimethyl 4-butyl-5-[1,2,3,4-tetrakis(oxidanyl)-6-phenyl-hex-5-enyl]pyridazine-3,6-dicarboxylate

Systemtic Name: dimethyl 4-butyl-5-[1,2,3,4-tetrakis(oxidanyl)-6-phenyl-hex-5-enyl]pyridazine-3,6-dicarboxylate Openeye Name: dimethyl 4-butyl-5-(1,2,3,4-tetrahydroxy-6-phenyl-hex-5-enyl)pyridazine-3,6-dicarboxylate CAS Name: 4-butyl-5-(1,2,3,4-tetrahydroxy-6-phenylhex-5-enyl)pyridazine-3,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-butyl-5-(1,2,3,4-tetrahydroxy-6-phenylhex-5-enyl)pyridazine-3,6-dicarboxylate Traditional Name: 4-butyl-5-(1,2,3,4-tetrahydroxy-6-phenyl-hex-5-enyl)pyridazine-3,6-dicarboxylic acid dimethyl ester Formula: C24H30N2O8 MolecularWeight: 474.5036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=NN=C1C(=O)OC)C(=O)OC)C(C(C(C(C=CC2=CC=CC=C2)O)O)O)O

Isomeric SMILES

CCCCC1=C(C(=NN=C1C(=O)OC)C(=O)OC)C(C(C(C(C=CC2=CC=CC=C2)O)O)O)O

InChI

InChI=1S/C24H30N2O8/c1-4-5-11-15-17(19(24(32)34-3)26-25-18(15)23(31)33-2)21(29)22(30)20(28)16(27)13-12-14-9-7-6-8-10-14/h6-10,12-13,16,20-22,27-30H,4-5,11H2,1-3H3