1-[1-(4-butoxyphenyl)-2-nitro-butyl]-4-ethoxy-benzene

Systemtic Name: 1-[1-(4-butoxyphenyl)-2-nitro-butyl]-4-ethoxy-benzene Openeye Name: 1-[1-(4-butoxyphenyl)-2-nitro-butyl]-4-ethoxy-benzene CAS Name: 1-[1-(4-butoxyphenyl)-2-nitrobutyl]-4-ethoxybenzene IUPAC Name: 1-[1-(4-butoxyphenyl)-2-nitrobutyl]-4-ethoxybenzene Traditional Name: 1-[1-(4-butoxyphenyl)-2-nitro-butyl]-4-ethoxy-benzene Formula: C22H29NO4 MolecularWeight: 371.46996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC)C(CC)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC)C(CC)[N+](=O)[O-]

InChI

InChI=1S/C22H29NO4/c1-4-7-16-27-20-14-10-18(11-15-20)22(21(5-2)23(24)25)17-8-12-19(13-9-17)26-6-3/h8-15,21-22H,4-7,16H2,1-3H3