methyl 3-[(3-azanyl-4-methoxy-phenyl)methylsulfonyl]propanoate

Systemtic Name: methyl 3-[(3-azanyl-4-methoxy-phenyl)methylsulfonyl]propanoate Openeye Name: methyl 3-[(3-amino-4-methoxy-phenyl)methylsulfonyl]propanoate CAS Name: 3-[(3-amino-4-methoxyphenyl)methylsulfonyl]propanoic acid methyl ester IUPAC Name: methyl 3-[(3-amino-4-methoxyphenyl)methylsulfonyl]propanoate Traditional Name: 3-(3-amino-4-methoxy-benzyl)sulfonylpropionic acid methyl ester Formula: C12H17NO5S MolecularWeight: 287.33208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CS(=O)(=O)CCC(=O)OC)N

Isomeric SMILES

COC1=C(C=C(C=C1)CS(=O)(=O)CCC(=O)OC)N

InChI

InChI=1S/C12H17NO5S/c1-17-11-4-3-9(7-10(11)13)8-19(15,16)6-5-12(14)18-2/h3-4,7H,5-6,8,13H2,1-2H3