methyl (Z,4S)-2-bromanyl-4-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]-5-phenyl-pent-2-enoate

Systemtic Name: methyl (Z,4S)-2-bromanyl-4-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]-5-phenyl-pent-2-enoate Openeye Name: methyl (Z,4S)-2-bromo-4-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]-5-phenyl-pent-2-enoate CAS Name: (Z,4S)-2-bromo-4-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]-5-phenyl-2-pentenoic acid methyl ester IUPAC Name: methyl (Z,4S)-2-bromo-4-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]-5-phenylpent-2-enoate Traditional Name: (Z,4S)-2-bromo-4-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]-5-phenyl-pent-2-enoic acid methyl ester Formula: C22H26BrNO5S MolecularWeight: 496.41454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1S(=O)(=O)NC(CC2=CC=CC=C2)C=C(C(=O)OC)Br)C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1S(=O)(=O)N[C@@H](CC2=CC=CC=C2)/C=C(/C(=O)OC)\Br)C)C)OC

InChI

InChI=1S/C22H26BrNO5S/c1-14-11-20(28-4)15(2)16(3)21(14)30(26,27)24-18(13-19(23)22(25)29-5)12-17-9-7-6-8-10-17/h6-11,13,18,24H,12H2,1-5H3/b19-13-/t18-/m0/s1