methyl 3-[2-(4-methoxyphenyl)ethyl-(3-nitrophenyl)sulfonyl-amino]propanoate

Systemtic Name: methyl 3-[2-(4-methoxyphenyl)ethyl-(3-nitrophenyl)sulfonyl-amino]propanoate Openeye Name: methyl 3-[2-(4-methoxyphenyl)ethyl-(3-nitrophenyl)sulfonyl-amino]propanoate CAS Name: 3-[2-(4-methoxyphenyl)ethyl-(3-nitrophenyl)sulfonylamino]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(4-methoxyphenyl)ethyl-(3-nitrophenyl)sulfonylamino]propanoate Traditional Name: 3-[2-(4-methoxyphenyl)ethyl-(3-nitrophenyl)sulfonyl-amino]propionic acid methyl ester Formula: C19H22N2O7S MolecularWeight: 422.45218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCN(CCC(=O)OC)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CCN(CCC(=O)OC)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H22N2O7S/c1-27-17-8-6-15(7-9-17)10-12-20(13-11-19(22)28-2)29(25,26)18-5-3-4-16(14-18)21(23)24/h3-9,14H,10-13H2,1-2H3