ethyl (3R)-3-[(2-methyl-5-nitro-phenyl)sulfonylamino]-3-(4-methylphenyl)propanoate

Systemtic Name: ethyl (3R)-3-[(2-methyl-5-nitro-phenyl)sulfonylamino]-3-(4-methylphenyl)propanoate Openeye Name: ethyl (3R)-3-[(2-methyl-5-nitro-phenyl)sulfonylamino]-3-(p-tolyl)propanoate CAS Name: (3R)-3-[(2-methyl-5-nitrophenyl)sulfonylamino]-3-(4-methylphenyl)propanoic acid ethyl ester IUPAC Name: ethyl (3R)-3-[(2-methyl-5-nitrophenyl)sulfonylamino]-3-(4-methylphenyl)propanoate Traditional Name: (3R)-3-[(2-methyl-5-nitro-phenyl)sulfonylamino]-3-(p-tolyl)propionic acid ethyl ester Formula: C19H22N2O6S MolecularWeight: 406.45278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O6S/c1-4-27-19(22)12-17(15-8-5-13(2)6-9-15)20-28(25,26)18-11-16(21(23)24)10-7-14(18)3/h5-11,17,20H,4,12H2,1-3H3/t17-/m1/s1