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

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

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)OC)N3CCN(CC3)C)(O)O

Isomeric SMILES

B(C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)OC)N3CCN(CC3)C)(O)O

InChI

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