(4-cyanophenyl)methyl 4-(naphthalen-2-ylsulfonylamino)butanoate

Systemtic Name: (4-cyanophenyl)methyl 4-(naphthalen-2-ylsulfonylamino)butanoate Openeye Name: (4-cyanophenyl)methyl 4-(2-naphthylsulfonylamino)butanoate CAS Name: 4-(2-naphthalenylsulfonylamino)butanoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 4-(naphthalen-2-ylsulfonylamino)butanoate Traditional Name: 4-(2-naphthylsulfonylamino)butyric acid (4-cyanobenzyl) ester Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)NCCCC(=O)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)NCCCC(=O)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H20N2O4S/c23-15-17-7-9-18(10-8-17)16-28-22(25)6-3-13-24-29(26,27)21-12-11-19-4-1-2-5-20(19)14-21/h1-2,4-5,7-12,14,24H,3,6,13,16H2