[2-[[anthracen-9-ylmethyl(propyl)amino]methyl]phenyl]boronic acid

Systemtic Name: [2-[[anthracen-9-ylmethyl(propyl)amino]methyl]phenyl]boronic acid Openeye Name: [2-[[9-anthrylmethyl(propyl)amino]methyl]phenyl]boronic acid CAS Name: [2-[[9-anthracenylmethyl(propyl)amino]methyl]phenyl]boronic acid IUPAC Name: [2-[[anthracen-9-ylmethyl(propyl)amino]methyl]phenyl]boronic acid Traditional Name: [2-[[9-anthrylmethyl(propyl)amino]methyl]phenyl]boronic acid Formula: C25H26BNO2 MolecularWeight: 383.29044

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=CC=C1CN(CCC)CC2=C3C=CC=CC3=CC4=CC=CC=C42)(O)O

Isomeric SMILES

B(C1=CC=CC=C1CN(CCC)CC2=C3C=CC=CC3=CC4=CC=CC=C42)(O)O

InChI

InChI=1S/C25H26BNO2/c1-2-15-27(17-21-11-5-8-14-25(21)26(28)29)18-24-22-12-6-3-9-19(22)16-20-10-4-7-13-23(20)24/h3-14,16,28-29H,2,15,17-18H2,1H3