(3-phenyl-2H-azirin-2-yl)methyl 4-nitrobenzoate

Systemtic Name: (3-phenyl-2H-azirin-2-yl)methyl 4-nitrobenzoate Openeye Name: (3-phenyl-2H-azirin-2-yl)methyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (3-phenyl-2H-azirin-2-yl)methyl ester IUPAC Name: (3-phenyl-2H-azirin-2-yl)methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (3-phenyl-2H-azirin-2-yl)methyl ester Formula: C16H12N2O4 MolecularWeight: 296.27748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC2COC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC2COC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O4/c19-16(12-6-8-13(9-7-12)18(20)21)22-10-14-15(17-14)11-4-2-1-3-5-11/h1-9,14H,10H2