5-methyl-6-nitro-1-(phenylmethyl)-3H-2,1-benzothiazole 2,2-dioxide

Systemtic Name: 5-methyl-6-nitro-1-(phenylmethyl)-3H-2,1-benzothiazole 2,2-dioxide Openeye Name: 1-benzyl-5-methyl-6-nitro-3H-2,1-benzothiazole 2,2-dioxide CAS Name: 5-methyl-6-nitro-1-(phenylmethyl)-3H-2,1-benzothiazole 2,2-dioxide IUPAC Name: 1-benzyl-5-methyl-6-nitro-3H-2,1-benzothiazole 2,2-dioxide Traditional Name: 1-benzyl-5-methyl-6-nitro-3H-2,1-benzothiazole 2,2-dioxide Formula: C15H14N2O4S MolecularWeight: 318.34766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)CS(=O)(=O)N2CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C2C(=C1)CS(=O)(=O)N2CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O4S/c1-11-7-13-10-22(20,21)16(9-12-5-3-2-4-6-12)15(13)8-14(11)17(18)19/h2-8H,9-10H2,1H3