1-butan-2-yl-4-[1-(4-ethoxyphenyl)-2-nitro-propyl]benzene

Systemtic Name: 1-butan-2-yl-4-[1-(4-ethoxyphenyl)-2-nitro-propyl]benzene Openeye Name: 1-[1-(4-ethoxyphenyl)-2-nitro-propyl]-4-sec-butyl-benzene CAS Name: 1-butan-2-yl-4-[1-(4-ethoxyphenyl)-2-nitropropyl]benzene IUPAC Name: 1-butan-2-yl-4-[1-(4-ethoxyphenyl)-2-nitropropyl]benzene Traditional Name: 1-(2-nitro-1-p-phenetyl-propyl)-4-sec-butyl-benzene Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC)C(C)[N+](=O)[O-]

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC)C(C)[N+](=O)[O-]

InChI

InChI=1S/C21H27NO3/c1-5-15(3)17-7-9-18(10-8-17)21(16(4)22(23)24)19-11-13-20(14-12-19)25-6-2/h7-16,21H,5-6H2,1-4H3