(3S,5S,6E)-5-methoxy-3-(4-methylphenyl)sulfonyl-1-(phenylmethyl)-6-prop-2-enylidene-piperidin-2-one

Systemtic Name: (3S,5S,6E)-5-methoxy-3-(4-methylphenyl)sulfonyl-1-(phenylmethyl)-6-prop-2-enylidene-piperidin-2-one Openeye Name: (3S,5S,6E)-6-allylidene-1-benzyl-5-methoxy-3-(p-tolylsulfonyl)piperidin-2-one CAS Name: (3S,5S,6E)-5-methoxy-3-(4-methylphenyl)sulfonyl-1-(phenylmethyl)-6-prop-2-enylidene-2-piperidinone IUPAC Name: (3S,5S,6E)-1-benzyl-5-methoxy-3-(4-methylphenyl)sulfonyl-6-prop-2-enylidenepiperidin-2-one Traditional Name: (3S,5S,6E)-6-allylidene-1-benzyl-5-methoxy-3-tosyl-2-piperidone Formula: C23H25NO4S MolecularWeight: 411.5139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2CC(C(=CC=C)N(C2=O)CC3=CC=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[C@H]2C[C@@H](/C(=C\C=C)/N(C2=O)CC3=CC=CC=C3)OC

InChI

InChI=1S/C23H25NO4S/c1-4-8-20-21(28-3)15-22(29(26,27)19-13-11-17(2)12-14-19)23(25)24(20)16-18-9-6-5-7-10-18/h4-14,21-22H,1,15-16H2,2-3H3/b20-8+/t21-,22-/m0/s1