1-nitro-4-pent-2-ynylsulfinyl-benzene

Systemtic Name: 1-nitro-4-pent-2-ynylsulfinyl-benzene Openeye Name: 1-nitro-4-pent-2-ynylsulfinyl-benzene CAS Name: 1-nitro-4-pent-2-ynylsulfinylbenzene IUPAC Name: 1-nitro-4-pent-2-ynylsulfinylbenzene Traditional Name: 1-nitro-4-pent-2-ynylsulfinyl-benzene Formula: C11H11NO3S MolecularWeight: 237.27494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO3S/c1-2-3-4-9-16(15)11-7-5-10(6-8-11)12(13)14/h5-8H,2,9H2,1H3