2-nitro-4-prop-2-ynylsulfinyl-aniline

Systemtic Name: 2-nitro-4-prop-2-ynylsulfinyl-aniline Openeye Name: 2-nitro-4-prop-2-ynylsulfinyl-aniline CAS Name: 2-nitro-4-prop-2-ynylsulfinylaniline IUPAC Name: 2-nitro-4-prop-2-ynylsulfinylaniline Traditional Name: (2-nitro-4-propargylsulfinyl-phenyl)amine Formula: C9H8N2O3S MolecularWeight: 224.23642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8N2O3S/c1-2-5-15(14)7-3-4-8(10)9(6-7)11(12)13/h1,3-4,6H,5,10H2