(E,5S)-7-(phenylsulfonyl)hept-6-ene-1,5-diamine

Systemtic Name: (E,5S)-7-(phenylsulfonyl)hept-6-ene-1,5-diamine Openeye Name: (E,5S)-7-(benzenesulfonyl)hept-6-ene-1,5-diamine CAS Name: (E,5S)-7-(benzenesulfonyl)-6-heptene-1,5-diamine IUPAC Name: (E,5S)-7-(benzenesulfonyl)hept-6-ene-1,5-diamine Traditional Name: [(E,5S)-5-amino-7-besyl-hept-6-enyl]amine Formula: C13H20N2O2S MolecularWeight: 268.3751

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C=CC(CCCCN)N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)/C=C/[C@H](CCCCN)N

InChI

InChI=1S/C13H20N2O2S/c14-10-5-4-6-12(15)9-11-18(16,17)13-7-2-1-3-8-13/h1-3,7-9,11-12H,4-6,10,14-15H2/b11-9+/t12-/m0/s1