N-[3-[2,4-bis(2-methylbutan-2-yl)phenoxy]propoxy]-4-chloranyl-3-nitro-aniline

Systemtic Name: N-[3-[2,4-bis(2-methylbutan-2-yl)phenoxy]propoxy]-4-chloranyl-3-nitro-aniline Openeye Name: N-[3-[2,4-bis(1,1-dimethylpropyl)phenoxy]propoxy]-4-chloro-3-nitro-aniline CAS Name: N-[3-[2,4-bis(2-methylbutan-2-yl)phenoxy]propoxy]-4-chloro-3-nitroaniline IUPAC Name: N-[3-[2,4-bis(2-methylbutan-2-yl)phenoxy]propoxy]-4-chloro-3-nitroaniline Traditional Name: (4-chloro-3-nitro-phenyl)-[3-(2,4-ditert-amylphenoxy)propoxy]amine Formula: C25H35ClN2O4 MolecularWeight: 463.0094

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCCONC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCCONC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(C)(C)CC

InChI

InChI=1S/C25H35ClN2O4/c1-7-24(3,4)18-10-13-23(20(16-18)25(5,6)8-2)31-14-9-15-32-27-19-11-12-21(26)22(17-19)28(29)30/h10-13,16-17,27H,7-9,14-15H2,1-6H3