N-[bis(azanyl)methylidene]-2-[3-oxidanylidene-2-(phenylmethyl)-1H-isoindol-1-yl]ethanamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-[3-oxidanylidene-2-(phenylmethyl)-1H-isoindol-1-yl]ethanamide Openeye Name: 2-(2-benzyl-3-oxo-isoindolin-1-yl)-N-(diaminomethylene)acetamide CAS Name: N-(diaminomethylidene)-2-[3-oxo-2-(phenylmethyl)-1H-isoindol-1-yl]acetamide IUPAC Name: 2-(2-benzyl-3-oxo-1H-isoindol-1-yl)-N-(diaminomethylidene)acetamide Traditional Name: 2-(2-benzyl-3-keto-isoindolin-1-yl)-N-(diaminomethylene)acetamide Formula: C18H18N4O2 MolecularWeight: 322.36112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(C3=CC=CC=C3C2=O)CC(=O)N=C(N)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C(C3=CC=CC=C3C2=O)CC(=O)N=C(N)N

InChI

InChI=1S/C18H18N4O2/c19-18(20)21-16(23)10-15-13-8-4-5-9-14(13)17(24)22(15)11-12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H4,19,20,21,23)