[7-[(6-chloranyl-1,3-benzothiazol-2-yl)amino]-7-oxidanylidene-heptyl]azanium

Systemtic Name: [7-[(6-chloranyl-1,3-benzothiazol-2-yl)amino]-7-oxidanylidene-heptyl]azanium Openeye Name: [7-[(6-chloro-1,3-benzothiazol-2-yl)amino]-7-oxo-heptyl]ammonium CAS Name: [7-[(6-chloro-1,3-benzothiazol-2-yl)amino]-7-oxoheptyl]ammonium IUPAC Name: [7-[(6-chloro-1,3-benzothiazol-2-yl)amino]-7-oxoheptyl]azanium Traditional Name: [7-[(6-chloro-1,3-benzothiazol-2-yl)amino]-7-keto-heptyl]ammonium Formula: C14H19ClN3OS+ MolecularWeight: 312.83816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)SC(=N2)NC(=O)CCCCCC[NH3+]

Isomeric SMILES

C1=CC2=C(C=C1Cl)SC(=N2)NC(=O)CCCCCC[NH3+]

InChI

InChI=1S/C14H18ClN3OS/c15-10-6-7-11-12(9-10)20-14(17-11)18-13(19)5-3-1-2-4-8-16/h6-7,9H,1-5,8,16H2,(H,17,18,19)/p+1