ethyl 3-[(3-cyanophenyl)sulfonyl-(phenylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[(3-cyanophenyl)sulfonyl-(phenylmethyl)amino]propanoate Openeye Name: ethyl 3-[benzyl-(3-cyanophenyl)sulfonyl-amino]propanoate CAS Name: 3-[(3-cyanophenyl)sulfonyl-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl-(3-cyanophenyl)sulfonylamino]propanoate Traditional Name: 3-[benzyl-(3-cyanophenyl)sulfonyl-amino]propionic acid ethyl ester Formula: C19H20N2O4S MolecularWeight: 372.4381

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C19H20N2O4S/c1-2-25-19(22)11-12-21(15-16-7-4-3-5-8-16)26(23,24)18-10-6-9-17(13-18)14-20/h3-10,13H,2,11-12,15H2,1H3