N-phenyl-2,2-dipropyl-3-oxa-7-thia-5-aza-1-azonia-2-boranuidabicyclo[4.3.0]nona-1(6),4,8-trien-4-amine

Systemtic Name: N-phenyl-2,2-dipropyl-3-oxa-7-thia-5-aza-1-azonia-2-boranuidabicyclo[4.3.0]nona-1(6),4,8-trien-4-amine Openeye Name: N-phenyl-2,2-dipropyl-3-oxa-7-thia-5-aza-1-azonia-2-boranuidabicyclo[4.3.0]nona-1(6),4,8-trien-4-amine CAS Name: N-phenyl-2,2-dipropyl-3-oxa-7-thia-5-aza-1-azonia-2-boranuidabicyclo[4.3.0]nona-1(6),4,8-trien-4-amine IUPAC Name: N-phenyl-2,2-dipropyl-3-oxa-7-thia-5-aza-1-azonia-2-boranuidabicyclo[4.3.0]nona-1(6),4,8-trien-4-amine Traditional Name: (2,2-dipropyl-3-oxa-7-thia-5-aza-1-azonia-2-boranuidabicyclo[4.3.0]nona-1(6),4,8-trien-4-yl)-phenyl-amine Formula: C16H22BN3OS MolecularWeight: 315.24138

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Descriptors Computed from Structure

Canonical SMILES:

[B-]1([N+]2=C(N=C(O1)NC3=CC=CC=C3)SC=C2)(CCC)CCC

Isomeric SMILES

[B-]1([N+]2=C(N=C(O1)NC3=CC=CC=C3)SC=C2)(CCC)CCC

InChI

InChI=1S/C16H22BN3OS/c1-3-10-17(11-4-2)20-12-13-22-16(20)19-15(21-17)18-14-8-6-5-7-9-14/h5-9,12-13H,3-4,10-11H2,1-2H3,(H,18,19)