3-(5-chloranyl-1,3-benzoxazol-2-yl)-N-[(4-chlorophenyl)methyl]pyridin-1-ium-2-amine

Systemtic Name: 3-(5-chloranyl-1,3-benzoxazol-2-yl)-N-[(4-chlorophenyl)methyl]pyridin-1-ium-2-amine Openeye Name: 3-(5-chloro-1,3-benzoxazol-2-yl)-N-[(4-chlorophenyl)methyl]pyridin-1-ium-2-amine CAS Name: 3-(5-chloro-1,3-benzoxazol-2-yl)-N-[(4-chlorophenyl)methyl]-2-pyridin-1-iumamine IUPAC Name: 3-(5-chloro-1,3-benzoxazol-2-yl)-N-[(4-chlorophenyl)methyl]pyridin-1-ium-2-amine Traditional Name: [3-(5-chloro-1,3-benzoxazol-2-yl)pyridin-1-ium-2-yl]-(4-chlorobenzyl)amine Formula: C19H14Cl2N3O+ MolecularWeight: 371.23996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C([NH+]=C1)NCC2=CC=C(C=C2)Cl)C3=NC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1=CC(=C([NH+]=C1)NCC2=CC=C(C=C2)Cl)C3=NC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C19H13Cl2N3O/c20-13-5-3-12(4-6-13)11-23-18-15(2-1-9-22-18)19-24-16-10-14(21)7-8-17(16)25-19/h1-10H,11H2,(H,22,23)/p+1