N-[[2-(1,2-benzoxazol-3-yl)phenyl]methyl]-1-pyridin-3-yl-methanamine dihydrochloride

Systemtic Name: N-[[2-(1,2-benzoxazol-3-yl)phenyl]methyl]-1-pyridin-3-yl-methanamine dihydrochloride Openeye Name: N-[[2-(1,2-benzoxazol-3-yl)phenyl]methyl]-1-(3-pyridyl)methanamine dihydrochloride CAS Name: N-[[2-(1,2-benzoxazol-3-yl)phenyl]methyl]-1-(3-pyridinyl)methanamine dihydrochloride IUPAC Name: N-[[2-(1,2-benzoxazol-3-yl)phenyl]methyl]-1-pyridin-3-ylmethanamine dihydrochloride Traditional Name: (2-indoxazen-3-ylbenzyl)-(3-pyridylmethyl)amine dihydrochloride Formula: C20H19Cl2N3O MolecularWeight: 388.29036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNCC2=CN=CC=C2)C3=NOC4=CC=CC=C43.Cl.Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNCC2=CN=CC=C2)C3=NOC4=CC=CC=C43.Cl.Cl

InChI

InChI=1S/C20H17N3O.2ClH/c1-2-8-17(20-18-9-3-4-10-19(18)24-23-20)16(7-1)14-22-13-15-6-5-11-21-12-15;;/h1-12,22H,13-14H2;2*1H