3-[3-(dimethylamino)propyl]-2-phenyl-1H-1,3,2-benzodiazaborinin-4-one

Systemtic Name: 3-[3-(dimethylamino)propyl]-2-phenyl-1H-1,3,2-benzodiazaborinin-4-one Openeye Name: 3-[3-(dimethylamino)propyl]-2-phenyl-1H-1,3,2-benzodiazaborinin-4-one CAS Name: 3-[3-(dimethylamino)propyl]-2-phenyl-1H-1,3,2-benzodiazaborin-4-one IUPAC Name: 3-[3-(dimethylamino)propyl]-2-phenyl-1H-1,3,2-benzodiazaborinin-4-one Traditional Name: 3-[3-(dimethylamino)propyl]-2-phenyl-1H-1,3,2-benzodiazaborin-4-one Formula: C18H22BN3O MolecularWeight: 307.19778

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Descriptors Computed from Structure

Canonical SMILES:

B1(NC2=CC=CC=C2C(=O)N1CCCN(C)C)C3=CC=CC=C3

Isomeric SMILES

B1(NC2=CC=CC=C2C(=O)N1CCCN(C)C)C3=CC=CC=C3

InChI

InChI=1S/C18H22BN3O/c1-21(2)13-8-14-22-18(23)16-11-6-7-12-17(16)20-19(22)15-9-4-3-5-10-15/h3-7,9-12,20H,8,13-14H2,1-2H3