N-[bis(azanyl)methylidene]-9-[(E)-hydroxyiminomethyl]-2,3-dihydro-1-benzoxepine-4-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=CC=C2C=NO)C=C1C(=O)N=C(N)N

Isomeric SMILES

C1COC2=C(C=CC=C2/C=N/O)C=C1C(=O)N=C(N)N

InChI

InChI=1S/C13H14N4O3/c14-13(15)17-12(18)9-4-5-20-11-8(6-9)2-1-3-10(11)7-16-19/h1-3,6-7,19H,4-5H2,(H4,14,15,17,18)/b16-7+