ethyl 3-[(3-nitrophenyl)sulfonylamino]-3-phenyl-propanoate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O6S/c1-2-25-17(20)12-16(13-7-4-3-5-8-13)18-26(23,24)15-10-6-9-14(11-15)19(21)22/h3-11,16,18H,2,12H2,1H3