ethyl 3-[(3,4-dimethoxyphenyl)methyl-(4-nitrophenyl)sulfonyl-amino]propanoate

Systemtic Name: ethyl 3-[(3,4-dimethoxyphenyl)methyl-(4-nitrophenyl)sulfonyl-amino]propanoate Openeye Name: ethyl 3-[(3,4-dimethoxyphenyl)methyl-(4-nitrophenyl)sulfonyl-amino]propanoate CAS Name: 3-[(3,4-dimethoxyphenyl)methyl-(4-nitrophenyl)sulfonylamino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(3,4-dimethoxyphenyl)methyl-(4-nitrophenyl)sulfonylamino]propanoate Traditional Name: 3-[nosyl(veratryl)amino]propionic acid ethyl ester Formula: C20H24N2O8S MolecularWeight: 452.47816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC(=C(C=C1)OC)OC)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCN(CC1=CC(=C(C=C1)OC)OC)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H24N2O8S/c1-4-30-20(23)11-12-21(14-15-5-10-18(28-2)19(13-15)29-3)31(26,27)17-8-6-16(7-9-17)22(24)25/h5-10,13H,4,11-12,14H2,1-3H3