1-(imidazol-1-ylmethyl)-4-nitro-xanthen-9-one

Systemtic Name: 1-(imidazol-1-ylmethyl)-4-nitro-xanthen-9-one Openeye Name: 1-(imidazol-1-ylmethyl)-4-nitro-xanthen-9-one CAS Name: 1-(1-imidazolylmethyl)-4-nitro-9-xanthenone IUPAC Name: 1-(imidazol-1-ylmethyl)-4-nitroxanthen-9-one Traditional Name: 1-(imidazol-1-ylmethyl)-4-nitro-xanthone Formula: C17H11N3O4 MolecularWeight: 321.28694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3O2)[N+](=O)[O-])CN4C=CN=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3O2)[N+](=O)[O-])CN4C=CN=C4

InChI

InChI=1S/C17H11N3O4/c21-16-12-3-1-2-4-14(12)24-17-13(20(22)23)6-5-11(15(16)17)9-19-8-7-18-10-19/h1-8,10H,9H2