2-methyl-4-nitro-1-prop-1-ynyl-benzene

Systemtic Name: 2-methyl-4-nitro-1-prop-1-ynyl-benzene Openeye Name: 2-methyl-4-nitro-1-prop-1-ynyl-benzene CAS Name: 2-methyl-4-nitro-1-prop-1-ynylbenzene IUPAC Name: 2-methyl-4-nitro-1-prop-1-ynylbenzene Traditional Name: 2-methyl-4-nitro-1-prop-1-ynyl-benzene Formula: C10H9NO2 MolecularWeight: 175.18396

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=C(C=C(C=C1)[N+](=O)[O-])C

Isomeric SMILES

CC#CC1=C(C=C(C=C1)[N+](=O)[O-])C

InChI

InChI=1S/C10H9NO2/c1-3-4-9-5-6-10(11(12)13)7-8(9)2/h5-7H,1-2H3