3-ethyl-2-naphthalen-1-yl-6-nitro-1H-1,3,2-benzodiazaborinin-4-one

Systemtic Name: 3-ethyl-2-naphthalen-1-yl-6-nitro-1H-1,3,2-benzodiazaborinin-4-one Openeye Name: 3-ethyl-2-(1-naphthyl)-6-nitro-1H-1,3,2-benzodiazaborinin-4-one CAS Name: 3-ethyl-2-(1-naphthalenyl)-6-nitro-1H-1,3,2-benzodiazaborin-4-one IUPAC Name: 3-ethyl-2-naphthalen-1-yl-6-nitro-1H-1,3,2-benzodiazaborinin-4-one Traditional Name: 3-ethyl-2-(1-naphthyl)-6-nitro-1H-1,3,2-benzodiazaborin-4-one Formula: C19H16BN3O3 MolecularWeight: 345.15964

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Descriptors Computed from Structure

Canonical SMILES:

B1(NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N1CC)C3=CC=CC4=CC=CC=C34

Isomeric SMILES

B1(NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N1CC)C3=CC=CC4=CC=CC=C34

InChI

InChI=1S/C19H16BN3O3/c1-2-22-19(24)16-12-14(23(25)26)10-11-18(16)21-20(22)17-9-5-7-13-6-3-4-8-15(13)17/h3-12,21H,2H2,1H3