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

Systemtic Name: 1-nitro-3-prop-2-enyl-benzene Openeye Name: 1-allyl-3-nitro-benzene CAS Name: 1-nitro-3-prop-2-enylbenzene IUPAC Name: 1-nitro-3-prop-2-enylbenzene Traditional Name: 1-allyl-3-nitro-benzene Formula: C9H9NO2 MolecularWeight: 163.17326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO2/c1-2-4-8-5-3-6-9(7-8)10(11)12/h2-3,5-7H,1,4H2