N,N-dimethyl-2-[4-[(Z)-2-nitroprop-1-enyl]phenyl]sulfanyl-ethanamine

Systemtic Name: N,N-dimethyl-2-[4-[(Z)-2-nitroprop-1-enyl]phenyl]sulfanyl-ethanamine Openeye Name: N,N-dimethyl-2-[4-[(Z)-2-nitroprop-1-enyl]phenyl]sulfanyl-ethanamine CAS Name: N,N-dimethyl-2-[[4-[(Z)-2-nitroprop-1-enyl]phenyl]thio]ethanamine IUPAC Name: N,N-dimethyl-2-[4-[(Z)-2-nitroprop-1-enyl]phenyl]sulfanylethanamine Traditional Name: dimethyl-[2-[[4-[(Z)-2-nitroprop-1-enyl]phenyl]thio]ethyl]amine Formula: C13H18N2O2S MolecularWeight: 266.35922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C(=C/C1=CC=C(C=C1)SCCN(C)C)/[N+](=O)[O-]

InChI

InChI=1S/C13H18N2O2S/c1-11(15(16)17)10-12-4-6-13(7-5-12)18-9-8-14(2)3/h4-7,10H,8-9H2,1-3H3/b11-10-