methyl (2R)-2-[(2-azanyl-4-phenylmethoxy-phenyl)sulfonyl-(2-bromoethyl)amino]propanoate

Systemtic Name: methyl (2R)-2-[(2-azanyl-4-phenylmethoxy-phenyl)sulfonyl-(2-bromoethyl)amino]propanoate Openeye Name: methyl (2R)-2-[(2-amino-4-benzyloxy-phenyl)sulfonyl-(2-bromoethyl)amino]propanoate CAS Name: (2R)-2-[(2-amino-4-phenylmethoxyphenyl)sulfonyl-(2-bromoethyl)amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(2-amino-4-phenylmethoxyphenyl)sulfonyl-(2-bromoethyl)amino]propanoate Traditional Name: (2R)-2-[(2-amino-4-benzoxy-phenyl)sulfonyl-(2-bromoethyl)amino]propionic acid methyl ester Formula: C19H23BrN2O5S MolecularWeight: 471.36532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)N(CCBr)S(=O)(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)N

Isomeric SMILES

C[C@H](C(=O)OC)N(CCBr)S(=O)(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)N

InChI

InChI=1S/C19H23BrN2O5S/c1-14(19(23)26-2)22(11-10-20)28(24,25)18-9-8-16(12-17(18)21)27-13-15-6-4-3-5-7-15/h3-9,12,14H,10-11,13,21H2,1-2H3/t14-/m1/s1