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

Systemtic Name: N-[bis(azanyl)methylidene]-9-[2-(hydroxymethyl)phenyl]-2,3-dihydro-1-benzoxepine-4-carboxamide Openeye Name: N-(diaminomethylene)-9-[2-(hydroxymethyl)phenyl]-2,3-dihydro-1-benzoxepine-4-carboxamide CAS Name: N-(diaminomethylidene)-9-[2-(hydroxymethyl)phenyl]-2,3-dihydro-1-benzoxepin-4-carboxamide IUPAC Name: N-(diaminomethylidene)-9-[2-(hydroxymethyl)phenyl]-2,3-dihydro-1-benzoxepine-4-carboxamide Traditional Name: N-(diaminomethylene)-9-(2-methylolphenyl)-2,3-dihydro-1-benzoxepin-4-carboxamide Formula: C19H19N3O3 MolecularWeight: 337.37246

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=CC=C2C=C1C(=O)N=C(N)N)C3=CC=CC=C3CO

Isomeric SMILES

C1COC2=C(C=CC=C2C=C1C(=O)N=C(N)N)C3=CC=CC=C3CO

InChI

InChI=1S/C19H19N3O3/c20-19(21)22-18(24)13-8-9-25-17-12(10-13)5-3-7-16(17)15-6-2-1-4-14(15)11-23/h1-7,10,23H,8-9,11H2,(H4,20,21,22,24)