1-nitro-3-prop-2-enyl-2-prop-2-ynoxy-benzene

Systemtic Name: 1-nitro-3-prop-2-enyl-2-prop-2-ynoxy-benzene Openeye Name: 1-allyl-3-nitro-2-prop-2-ynoxy-benzene CAS Name: 1-nitro-3-prop-2-enyl-2-prop-2-ynoxybenzene IUPAC Name: 1-nitro-3-prop-2-enyl-2-prop-2-ynoxybenzene Traditional Name: 1-allyl-3-nitro-2-propargyloxy-benzene Formula: C12H11NO3 MolecularWeight: 217.22064

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C(=CC=C1)[N+](=O)[O-])OCC#C

Isomeric SMILES

C=CCC1=C(C(=CC=C1)[N+](=O)[O-])OCC#C

InChI

InChI=1S/C12H11NO3/c1-3-6-10-7-5-8-11(13(14)15)12(10)16-9-4-2/h2-3,5,7-8H,1,6,9H2