methyl 2-[(2-nitrophenyl)methylsulfonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[(2-nitrophenyl)methylsulfonylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[(2-nitrophenyl)methylsulfonylamino]-3-phenyl-propanoate CAS Name: 2-[(2-nitrophenyl)methylsulfonylamino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[(2-nitrophenyl)methylsulfonylamino]-3-phenylpropanoate Traditional Name: 2-[(2-nitrobenzyl)sulfonylamino]-3-phenyl-propionic acid methyl ester Formula: C17H18N2O6S MolecularWeight: 378.39962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NS(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NS(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O6S/c1-25-17(20)15(11-13-7-3-2-4-8-13)18-26(23,24)12-14-9-5-6-10-16(14)19(21)22/h2-10,15,18H,11-12H2,1H3