[1-(phenylcarbamoyl)pyren-2-yl]boronic acid

Systemtic Name: [1-(phenylcarbamoyl)pyren-2-yl]boronic acid Openeye Name: [1-(phenylcarbamoyl)pyren-2-yl]boronic acid CAS Name: [1-[anilino(oxo)methyl]-2-pyrenyl]boronic acid IUPAC Name: [1-(phenylcarbamoyl)pyren-2-yl]boronic acid Traditional Name: [1-(phenylcarbamoyl)pyren-2-yl]boronic acid Formula: C23H16BNO3 MolecularWeight: 365.18904

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC2=C3C(=C1C(=O)NC4=CC=CC=C4)C=CC5=CC=CC(=C53)C=C2)(O)O

Isomeric SMILES

B(C1=CC2=C3C(=C1C(=O)NC4=CC=CC=C4)C=CC5=CC=CC(=C53)C=C2)(O)O

InChI

InChI=1S/C23H16BNO3/c26-23(25-17-7-2-1-3-8-17)22-18-12-11-15-6-4-5-14-9-10-16(21(18)20(14)15)13-19(22)24(27)28/h1-13,27-28H,(H,25,26)