3,6-diethyl-N1,N4-bis(3-methoxyphenyl)-1,2,4,5-tetrazine-1,4-dicarboxamide

Systemtic Name: 3,6-diethyl-N1,N4-bis(3-methoxyphenyl)-1,2,4,5-tetrazine-1,4-dicarboxamide Openeye Name: 3,6-diethyl-N1,N4-bis(3-methoxyphenyl)-1,2,4,5-tetrazine-1,4-dicarboxamide CAS Name: 3,6-diethyl-N1,N4-bis(3-methoxyphenyl)-1,2,4,5-tetrazine-1,4-dicarboxamide IUPAC Name: 3,6-diethyl-1-N,4-N-bis(3-methoxyphenyl)-1,2,4,5-tetrazine-1,4-dicarboxamide Traditional Name: 3,6-diethyl-N,N'-bis(3-methoxyphenyl)-1,2,4,5-tetrazine-1,4-dicarboxamide Formula: C22H26N6O4 MolecularWeight: 438.47964

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=NN1C(=O)NC2=CC(=CC=C2)OC)CC)C(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

CCC1=NN(C(=NN1C(=O)NC2=CC(=CC=C2)OC)CC)C(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H26N6O4/c1-5-19-25-28(22(30)24-16-10-8-12-18(14-16)32-4)20(6-2)26-27(19)21(29)23-15-9-7-11-17(13-15)31-3/h7-14H,5-6H2,1-4H3,(H,23,29)(H,24,30)