1,3-benzothiazol-2-ylmethyl-[(5-chloranyl-2-oxidanyl-phenyl)methyl]azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[(5-chloranyl-2-oxidanyl-phenyl)methyl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[(5-chloro-2-hydroxy-phenyl)methyl]ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[(5-chloro-2-hydroxyphenyl)methyl]ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[(5-chloro-2-hydroxyphenyl)methyl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-(5-chloro-2-hydroxy-benzyl)ammonium Formula: C15H14ClN2OS+ MolecularWeight: 305.80246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C[NH2+]CC3=C(C=CC(=C3)Cl)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C[NH2+]CC3=C(C=CC(=C3)Cl)O

InChI

InChI=1S/C15H13ClN2OS/c16-11-5-6-13(19)10(7-11)8-17-9-15-18-12-3-1-2-4-14(12)20-15/h1-7,17,19H,8-9H2/p+1