3,5-dimethyl-N-(2-morpholin-4-ylethyl)-4-oxidanylidene-1,2,3,5-benzotetrazepine-8-carboxamide

Systemtic Name: 3,5-dimethyl-N-(2-morpholin-4-ylethyl)-4-oxidanylidene-1,2,3,5-benzotetrazepine-8-carboxamide Openeye Name: 3,5-dimethyl-N-(2-morpholinoethyl)-4-oxo-1,2,3,5-benzotetrazepine-8-carboxamide CAS Name: 3,5-dimethyl-N-[2-(4-morpholinyl)ethyl]-4-oxo-1,2,3,5-benzotetrazepine-8-carboxamide IUPAC Name: 3,5-dimethyl-N-(2-morpholin-4-ylethyl)-4-oxo-1,2,3,5-benzotetrazepine-8-carboxamide Traditional Name: 4-keto-3,5-dimethyl-N-(2-morpholinoethyl)-1,2,3,5-benzotetrazepine-8-carboxamide Formula: C16H22N6O3 MolecularWeight: 346.38428

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)NCCN3CCOCC3)N=NN(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)NCCN3CCOCC3)N=NN(C1=O)C

InChI

InChI=1S/C16H22N6O3/c1-20-14-4-3-12(11-13(14)18-19-21(2)16(20)24)15(23)17-5-6-22-7-9-25-10-8-22/h3-4,11H,5-10H2,1-2H3,(H,17,23)