1-tert-butyl-4-[4-(4-ethoxyphenyl)-3-nitro-butyl]benzene

Systemtic Name: 1-tert-butyl-4-[4-(4-ethoxyphenyl)-3-nitro-butyl]benzene Openeye Name: 1-tert-butyl-4-[4-(4-ethoxyphenyl)-3-nitro-butyl]benzene CAS Name: 1-tert-butyl-4-[4-(4-ethoxyphenyl)-3-nitrobutyl]benzene IUPAC Name: 1-tert-butyl-4-[4-(4-ethoxyphenyl)-3-nitrobutyl]benzene Traditional Name: 1-tert-butyl-4-(3-nitro-4-p-phenetyl-butyl)benzene Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC(CCC2=CC=C(C=C2)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)CC(CCC2=CC=C(C=C2)C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H29NO3/c1-5-26-21-14-9-18(10-15-21)16-20(23(24)25)13-8-17-6-11-19(12-7-17)22(2,3)4/h6-7,9-12,14-15,20H,5,8,13,16H2,1-4H3