N4-[bis(azanyl)methylidene]-2,3-dihydro-1-benzoxepine-4,9-dicarboxamide

Systemtic Name: N4-[bis(azanyl)methylidene]-2,3-dihydro-1-benzoxepine-4,9-dicarboxamide Openeye Name: N4-(diaminomethylene)-2,3-dihydro-1-benzoxepine-4,9-dicarboxamide CAS Name: N4-(diaminomethylidene)-2,3-dihydro-1-benzoxepin-4,9-dicarboxamide IUPAC Name: 4-N-(diaminomethylidene)-2,3-dihydro-1-benzoxepine-4,9-dicarboxamide Traditional Name: N-(diaminomethylene)-2,3-dihydro-1-benzoxepin-4,9-dicarboxamide Formula: C13H14N4O3 MolecularWeight: 274.27526

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=CC=C2C(=O)N)C=C1C(=O)N=C(N)N

Isomeric SMILES

C1COC2=C(C=CC=C2C(=O)N)C=C1C(=O)N=C(N)N

InChI

InChI=1S/C13H14N4O3/c14-11(18)9-3-1-2-7-6-8(4-5-20-10(7)9)12(19)17-13(15)16/h1-3,6H,4-5H2,(H2,14,18)(H4,15,16,17,19)