4-[3-(1-oxidanylidene-3H-2-benzofuran-5-yl)prop-2-ynylamino]benzenecarboximidamide

Systemtic Name: 4-[3-(1-oxidanylidene-3H-2-benzofuran-5-yl)prop-2-ynylamino]benzenecarboximidamide Openeye Name: 4-[3-(1-oxo-3H-isobenzofuran-5-yl)prop-2-ynylamino]benzamidine CAS Name: 4-[3-(1-oxo-3H-isobenzofuran-5-yl)prop-2-ynylamino]benzenecarboximidamide IUPAC Name: 4-[3-(1-oxo-3H-2-benzofuran-5-yl)prop-2-ynylamino]benzenecarboximidamide Traditional Name: 4-[3-(1-ketophthalan-5-yl)prop-2-ynylamino]benzamidine Formula: C18H15N3O2 MolecularWeight: 305.3306

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)C#CCNC3=CC=C(C=C3)C(=N)N)C(=O)O1

Isomeric SMILES

C1C2=C(C=CC(=C2)C#CCNC3=CC=C(C=C3)C(=N)N)C(=O)O1

InChI

InChI=1S/C18H15N3O2/c19-17(20)13-4-6-15(7-5-13)21-9-1-2-12-3-8-16-14(10-12)11-23-18(16)22/h3-8,10,21H,9,11H2,(H3,19,20)