methyl (2S)-2-[4-methylpent-3-enyl-(4-methylphenyl)sulfonyl-amino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[4-methylpent-3-enyl-(4-methylphenyl)sulfonyl-amino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[4-methylpent-3-enyl(p-tolylsulfonyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[4-methylpent-3-enyl-(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[4-methylpent-3-enyl-(4-methylphenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: (2S)-2-[4-methylpent-3-enyl(tosyl)amino]-3-phenyl-propionic acid methyl ester Formula: C23H29NO4S MolecularWeight: 415.54566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC=C(C)C)C(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC=C(C)C)[C@@H](CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C23H29NO4S/c1-18(2)9-8-16-24(29(26,27)21-14-12-19(3)13-15-21)22(23(25)28-4)17-20-10-6-5-7-11-20/h5-7,9-15,22H,8,16-17H2,1-4H3/t22-/m0/s1