[4-[ethyl-(phenylmethyl)carbamoyl]phenyl]boronic acid

Systemtic Name: [4-[ethyl-(phenylmethyl)carbamoyl]phenyl]boronic acid Openeye Name: [4-[benzyl(ethyl)carbamoyl]phenyl]boronic acid CAS Name: [4-[[ethyl-(phenylmethyl)amino]-oxomethyl]phenyl]boronic acid IUPAC Name: [4-[benzyl(ethyl)carbamoyl]phenyl]boronic acid Traditional Name: [4-[benzyl(ethyl)carbamoyl]phenyl]boronic acid Formula: C16H18BNO3 MolecularWeight: 283.13002

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)C(=O)N(CC)CC2=CC=CC=C2)(O)O

Isomeric SMILES

B(C1=CC=C(C=C1)C(=O)N(CC)CC2=CC=CC=C2)(O)O

InChI

InChI=1S/C16H18BNO3/c1-2-18(12-13-6-4-3-5-7-13)16(19)14-8-10-15(11-9-14)17(20)21/h3-11,20-21H,2,12H2,1H3