[2-aminocarbonyl-3-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]phenyl]boronic acid

Systemtic Name: [2-aminocarbonyl-3-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]phenyl]boronic acid Openeye Name: [2-carbamoyl-3-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]phenyl]boronic acid CAS Name: [2-carbamoyl-3-[4-methoxy-3-(4-methyl-1-piperazinyl)phenyl]phenyl]boronic acid IUPAC Name: [2-carbamoyl-3-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]phenyl]boronic acid Traditional Name: [2-carbamoyl-3-[4-methoxy-3-(4-methylpiperazino)phenyl]phenyl]boronic acid Formula: C19H24BN3O4 MolecularWeight: 369.22256

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=C(C(=CC=C1)C2=CC(=C(C=C2)OC)N3CCN(CC3)C)C(=O)N)(O)O

Isomeric SMILES

B(C1=C(C(=CC=C1)C2=CC(=C(C=C2)OC)N3CCN(CC3)C)C(=O)N)(O)O

InChI

InChI=1S/C19H24BN3O4/c1-22-8-10-23(11-9-22)16-12-13(6-7-17(16)27-2)14-4-3-5-15(20(25)26)18(14)19(21)24/h3-7,12,25-26H,8-11H2,1-2H3,(H2,21,24)