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

Systemtic Name: 4-(imidazol-1-ylmethyl)-1-nitro-xanthen-9-one Openeye Name: 4-(imidazol-1-ylmethyl)-1-nitro-xanthen-9-one CAS Name: 4-(1-imidazolylmethyl)-1-nitro-9-xanthenone IUPAC Name: 4-(imidazol-1-ylmethyl)-1-nitroxanthen-9-one Traditional Name: 4-(imidazol-1-ylmethyl)-1-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)CN4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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