1-(nitromethyl)-4-propan-2-yl-benzene

Systemtic Name: 1-(nitromethyl)-4-propan-2-yl-benzene Openeye Name: 1-isopropyl-4-(nitromethyl)benzene CAS Name: 1-(nitromethyl)-4-propan-2-ylbenzene IUPAC Name: 1-(nitromethyl)-4-propan-2-ylbenzene Traditional Name: 1-isopropyl-4-(nitromethyl)benzene Formula: C10H13NO2 MolecularWeight: 179.21572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13NO2/c1-8(2)10-5-3-9(4-6-10)7-11(12)13/h3-6,8H,7H2,1-2H3