1-(3-bromanyl-1-methoxy-propyl)-2-nitro-4-propan-2-yl-benzene

Systemtic Name: 1-(3-bromanyl-1-methoxy-propyl)-2-nitro-4-propan-2-yl-benzene Openeye Name: 1-(3-bromo-1-methoxy-propyl)-4-isopropyl-2-nitro-benzene CAS Name: 1-(3-bromo-1-methoxypropyl)-2-nitro-4-propan-2-ylbenzene IUPAC Name: 1-(3-bromo-1-methoxypropyl)-2-nitro-4-propan-2-ylbenzene Traditional Name: 1-(3-bromo-1-methoxy-propyl)-4-isopropyl-2-nitro-benzene Formula: C13H18BrNO3 MolecularWeight: 316.19092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18BrNO3/c1-9(2)10-4-5-11(12(8-10)15(16)17)13(18-3)6-7-14/h4-5,8-9,13H,6-7H2,1-3H3