1-isocyanato-2-naphthalen-2-ylsulfonyl-ethanone

Systemtic Name: 1-isocyanato-2-naphthalen-2-ylsulfonyl-ethanone Openeye Name: 2-(2-naphthylsulfonyl)acetyl isocyanate CAS Name: 1-isocyanato-2-(2-naphthalenylsulfonyl)ethanone IUPAC Name: 2-naphthalen-2-ylsulfonylacetyl isocyanate Traditional Name: 1-isocyanato-2-(2-naphthylsulfonyl)ethanone Formula: C13H9NO4S MolecularWeight: 275.27986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)CC(=O)N=C=O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)CC(=O)N=C=O

InChI

InChI=1S/C13H9NO4S/c15-9-14-13(16)8-19(17,18)12-6-5-10-3-1-2-4-11(10)7-12/h1-7H,8H2