1-nitro-4-prop-1-ynylsulfanyl-benzene

Systemtic Name: 1-nitro-4-prop-1-ynylsulfanyl-benzene Openeye Name: 1-nitro-4-prop-1-ynylsulfanyl-benzene CAS Name: 1-nitro-4-(prop-1-ynylthio)benzene IUPAC Name: 1-nitro-4-prop-1-ynylsulfanylbenzene Traditional Name: 1-nitro-4-(prop-1-ynylthio)benzene Formula: C9H7NO2S MolecularWeight: 193.22238

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Descriptors Computed from Structure

Canonical SMILES:

CC#CSC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC#CSC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C9H7NO2S/c1-2-7-13-9-5-3-8(4-6-9)10(11)12/h3-6H,1H3