(E)-3-(2-azanyl-1,3-benzothiazol-3-ium-3-yl)-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-(2-azanyl-1,3-benzothiazol-3-ium-3-yl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(2-amino-1,3-benzothiazol-3-ium-3-yl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-(2-amino-1,3-benzothiazol-3-ium-3-yl)-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(2-amino-1,3-benzothiazol-3-ium-3-yl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-(2-amino-1,3-benzothiazol-3-ium-3-yl)-1-phenyl-prop-2-en-1-one Formula: C16H13N2OS+ MolecularWeight: 281.35222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C=C[N+]2=C(SC3=CC=CC=C32)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)/C=C/[N+]2=C(SC3=CC=CC=C32)N

InChI

InChI=1S/C16H12N2OS/c17-16-18(13-8-4-5-9-15(13)20-16)11-10-14(19)12-6-2-1-3-7-12/h1-11,17H/p+1/b11-10+