2-(3-imidazol-1-ylpropyliminomethyl)-3-oxidanylidene-inden-1-olate

Systemtic Name: 2-(3-imidazol-1-ylpropyliminomethyl)-3-oxidanylidene-inden-1-olate Openeye Name: 2-(3-imidazol-1-ylpropyliminomethyl)-3-oxo-inden-1-olate CAS Name: 2-[3-(1-imidazolyl)propyliminomethyl]-3-oxo-1-indenolate IUPAC Name: 2-(3-imidazol-1-ylpropyliminomethyl)-3-oxoinden-1-olate Traditional Name: 2-(3-imidazol-1-ylpropyliminomethyl)-3-keto-inden-1-olate Formula: C16H14N3O2- MolecularWeight: 280.30126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C2=O)C=NCCCN3C=CN=C3)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C2=O)C=NCCCN3C=CN=C3)[O-]

InChI

InChI=1S/C16H15N3O2/c20-15-12-4-1-2-5-13(12)16(21)14(15)10-17-6-3-8-19-9-7-18-11-19/h1-2,4-5,7,9-11,20H,3,6,8H2/p-1