methyl (2S)-2-[(4-bromanyl-3-methyl-phenyl)sulfonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[(4-bromanyl-3-methyl-phenyl)sulfonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[(4-bromo-3-methyl-phenyl)sulfonylamino]-3-phenyl-propanoate CAS Name: (2S)-2-[(4-bromo-3-methylphenyl)sulfonylamino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(4-bromo-3-methylphenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: (2S)-2-[(4-bromo-3-methyl-phenyl)sulfonylamino]-3-phenyl-propionic acid methyl ester Formula: C17H18BrNO4S MolecularWeight: 412.29812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)OC)Br

Isomeric SMILES

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

InChI

InChI=1S/C17H18BrNO4S/c1-12-10-14(8-9-15(12)18)24(21,22)19-16(17(20)23-2)11-13-6-4-3-5-7-13/h3-10,16,19H,11H2,1-2H3/t16-/m0/s1