3-[(E)-4-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-but-2-enyl]sulfanyl-N-(phenylmethyl)propan-1-imine oxide

Systemtic Name: 3-[(E)-4-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-but-2-enyl]sulfanyl-N-(phenylmethyl)propan-1-imine oxide Openeye Name: N-benzyl-3-[(E)-4-tert-butoxy-4-oxo-but-2-enyl]sulfanyl-propan-1-imine oxide CAS Name: 3-[[(E)-4-[(2-methylpropan-2-yl)oxy]-4-oxobut-2-enyl]thio]-N-(phenylmethyl)-1-propanimine oxide IUPAC Name: N-benzyl-3-[(E)-4-[(2-methylpropan-2-yl)oxy]-4-oxobut-2-enyl]sulfanylpropan-1-imine oxide Traditional Name: N-benzyl-3-[[(E)-4-tert-butoxy-4-keto-but-2-enyl]thio]propan-1-imine oxide Formula: C18H25NO3S MolecularWeight: 335.461

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)OC(=O)/C=C/CSCC/C=[N+](/CC1=CC=CC=C1)\[O-]

InChI

InChI=1S/C18H25NO3S/c1-18(2,3)22-17(20)11-7-13-23-14-8-12-19(21)15-16-9-5-4-6-10-16/h4-7,9-12H,8,13-15H2,1-3H3/b11-7+,19-12-