1-(7-ethoxy-3,7-dimethyl-octyl)sulfanyl-4-nitro-benzene

Systemtic Name: 1-(7-ethoxy-3,7-dimethyl-octyl)sulfanyl-4-nitro-benzene Openeye Name: 1-(7-ethoxy-3,7-dimethyl-octyl)sulfanyl-4-nitro-benzene CAS Name: 1-[(7-ethoxy-3,7-dimethyloctyl)thio]-4-nitrobenzene IUPAC Name: 1-(7-ethoxy-3,7-dimethyloctyl)sulfanyl-4-nitrobenzene Traditional Name: 1-[(7-ethoxy-3,7-dimethyl-octyl)thio]-4-nitro-benzene Formula: C18H29NO3S MolecularWeight: 339.49276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)(C)CCCC(C)CCSC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCOC(C)(C)CCCC(C)CCSC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C18H29NO3S/c1-5-22-18(3,4)13-6-7-15(2)12-14-23-17-10-8-16(9-11-17)19(20)21/h8-11,15H,5-7,12-14H2,1-4H3