ethyl (E,4R,6R)-6-acetyloxy-4-[but-3-enyl-(4-methylphenyl)sulfonyl-amino]-6-phenyl-hex-2-enoate

Systemtic Name: ethyl (E,4R,6R)-6-acetyloxy-4-[but-3-enyl-(4-methylphenyl)sulfonyl-amino]-6-phenyl-hex-2-enoate Openeye Name: ethyl (E,4R,6R)-6-acetoxy-4-[but-3-enyl(p-tolylsulfonyl)amino]-6-phenyl-hex-2-enoate CAS Name: (E,4R,6R)-6-acetyloxy-4-[but-3-enyl-(4-methylphenyl)sulfonylamino]-6-phenyl-2-hexenoic acid ethyl ester IUPAC Name: ethyl (E,4R,6R)-6-acetyloxy-4-[but-3-enyl-(4-methylphenyl)sulfonylamino]-6-phenylhex-2-enoate Traditional Name: (E,4R,6R)-6-acetoxy-4-[but-3-enyl(tosyl)amino]-6-phenyl-hex-2-enoic acid ethyl ester Formula: C27H33NO6S MolecularWeight: 499.61902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(CC(C1=CC=CC=C1)OC(=O)C)N(CCC=C)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)/C=C/[C@@H](C[C@H](C1=CC=CC=C1)OC(=O)C)N(CCC=C)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C27H33NO6S/c1-5-7-19-28(35(31,32)25-16-13-21(3)14-17-25)24(15-18-27(30)33-6-2)20-26(34-22(4)29)23-11-9-8-10-12-23/h5,8-18,24,26H,1,6-7,19-20H2,2-4H3/b18-15+/t24-,26+/m0/s1