ethyl (2S)-3-(4-methoxy-3-nitro-phenyl)-2-(phenylsulfonylamino)propanoate

Systemtic Name: ethyl (2S)-3-(4-methoxy-3-nitro-phenyl)-2-(phenylsulfonylamino)propanoate Openeye Name: ethyl (2S)-2-(benzenesulfonamido)-3-(4-methoxy-3-nitro-phenyl)propanoate CAS Name: (2S)-2-(benzenesulfonamido)-3-(4-methoxy-3-nitrophenyl)propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-(benzenesulfonamido)-3-(4-methoxy-3-nitrophenyl)propanoate Traditional Name: (2S)-2-(benzenesulfonamido)-3-(4-methoxy-3-nitro-phenyl)propionic acid ethyl ester Formula: C18H20N2O7S MolecularWeight: 408.4256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)[C@H](CC1=CC(=C(C=C1)OC)[N+](=O)[O-])NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H20N2O7S/c1-3-27-18(21)15(19-28(24,25)14-7-5-4-6-8-14)11-13-9-10-17(26-2)16(12-13)20(22)23/h4-10,12,15,19H,3,11H2,1-2H3/t15-/m0/s1