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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C2=CC=C(C=C2)CC(C)C)C(C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C(C2=CC=C(C=C2)CC(C)C)C(C)[N+](=O)[O-]

InChI

InChI=1S/C21H27NO3/c1-5-25-20-12-10-19(11-13-20)21(16(4)22(23)24)18-8-6-17(7-9-18)14-15(2)3/h6-13,15-16,21H,5,14H2,1-4H3