1-[4-[4-(1,3-dithiolan-2-yl)phenoxy]-3-nitro-phenyl]ethanone

Systemtic Name: 1-[4-[4-(1,3-dithiolan-2-yl)phenoxy]-3-nitro-phenyl]ethanone Openeye Name: 1-[4-[4-(1,3-dithiolan-2-yl)phenoxy]-3-nitro-phenyl]ethanone CAS Name: 1-[4-[4-(1,3-dithiolan-2-yl)phenoxy]-3-nitrophenyl]ethanone IUPAC Name: 1-[4-[4-(1,3-dithiolan-2-yl)phenoxy]-3-nitrophenyl]ethanone Traditional Name: 1-[4-[4-(1,3-dithiolan-2-yl)phenoxy]-3-nitro-phenyl]ethanone Formula: C17H15NO4S2 MolecularWeight: 361.4353

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC2=CC=C(C=C2)C3SCCS3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC2=CC=C(C=C2)C3SCCS3)[N+](=O)[O-]

InChI

InChI=1S/C17H15NO4S2/c1-11(19)13-4-7-16(15(10-13)18(20)21)22-14-5-2-12(3-6-14)17-23-8-9-24-17/h2-7,10,17H,8-9H2,1H3