(1-azanyl-3-methyl-butyl)boronic acid; 2-(quinolin-2-ylamino)propanoic acid

Systemtic Name: (1-azanyl-3-methyl-butyl)boronic acid; 2-(quinolin-2-ylamino)propanoic acid Openeye Name: (1-amino-3-methyl-butyl)boronic acid; 2-(2-quinolylamino)propanoic acid CAS Name: (1-amino-3-methylbutyl)boronic acid; 2-(2-quinolinylamino)propanoic acid IUPAC Name: (1-amino-3-methylbutyl)boronic acid; 2-(quinolin-2-ylamino)propanoic acid Traditional Name: (1-amino-3-methyl-butyl)boronic acid; 2-(2-quinolylamino)propionic acid Formula: C17H26BN3O4 MolecularWeight: 347.21704

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Descriptors Computed from Structure

Canonical SMILES:

B(C(CC(C)C)N)(O)O.CC(C(=O)O)NC1=NC2=CC=CC=C2C=C1

Isomeric SMILES

B(C(CC(C)C)N)(O)O.CC(C(=O)O)NC1=NC2=CC=CC=C2C=C1

InChI

InChI=1S/C12H12N2O2.C5H14BNO2/c1-8(12(15)16)13-11-7-6-9-4-2-3-5-10(9)14-11;1-4(2)3-5(7)6(8)9/h2-8H,1H3,(H,13,14)(H,15,16);4-5,8-9H,3,7H2,1-2H3