1-(3,3-dimethyl-4-phenyl-but-1-en-2-yl)sulfanyl-4-nitro-benzene

Systemtic Name: 1-(3,3-dimethyl-4-phenyl-but-1-en-2-yl)sulfanyl-4-nitro-benzene Openeye Name: 1-(2,2-dimethyl-1-methylene-3-phenyl-propyl)sulfanyl-4-nitro-benzene CAS Name: 1-[(3,3-dimethyl-4-phenylbut-1-en-2-yl)thio]-4-nitrobenzene IUPAC Name: 1-(3,3-dimethyl-4-phenylbut-1-en-2-yl)sulfanyl-4-nitrobenzene Traditional Name: 1-[1-(1,1-dimethyl-2-phenyl-ethyl)vinylthio]-4-nitro-benzene Formula: C18H19NO2S MolecularWeight: 313.41396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=CC=C1)C(=C)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(CC1=CC=CC=C1)C(=C)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H19NO2S/c1-14(18(2,3)13-15-7-5-4-6-8-15)22-17-11-9-16(10-12-17)19(20)21/h4-12H,1,13H2,2-3H3