2-(1,3-benzothiazol-2-ylmethyl)-3-methyl-4-nitro-phenol

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethyl)-3-methyl-4-nitro-phenol Openeye Name: 2-(1,3-benzothiazol-2-ylmethyl)-3-methyl-4-nitro-phenol CAS Name: 2-(1,3-benzothiazol-2-ylmethyl)-3-methyl-4-nitrophenol IUPAC Name: 2-(1,3-benzothiazol-2-ylmethyl)-3-methyl-4-nitrophenol Traditional Name: 2-(1,3-benzothiazol-2-ylmethyl)-3-methyl-4-nitro-phenol Formula: C15H12N2O3S MolecularWeight: 300.33238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1CC2=NC3=CC=CC=C3S2)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1CC2=NC3=CC=CC=C3S2)O)[N+](=O)[O-]

InChI

InChI=1S/C15H12N2O3S/c1-9-10(13(18)7-6-12(9)17(19)20)8-15-16-11-4-2-3-5-14(11)21-15/h2-7,18H,8H2,1H3