methyl 3-(3-cyanophenyl)-2-(naphthalen-1-ylsulfonylamino)propanoate

Systemtic Name: methyl 3-(3-cyanophenyl)-2-(naphthalen-1-ylsulfonylamino)propanoate Openeye Name: methyl 3-(3-cyanophenyl)-2-(1-naphthylsulfonylamino)propanoate CAS Name: 3-(3-cyanophenyl)-2-(1-naphthalenylsulfonylamino)propanoic acid methyl ester IUPAC Name: methyl 3-(3-cyanophenyl)-2-(naphthalen-1-ylsulfonylamino)propanoate Traditional Name: 3-(3-cyanophenyl)-2-(1-naphthylsulfonylamino)propionic acid methyl ester Formula: C21H18N2O4S MolecularWeight: 394.44362

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC(=C1)C#N)NS(=O)(=O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

COC(=O)C(CC1=CC=CC(=C1)C#N)NS(=O)(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H18N2O4S/c1-27-21(24)19(13-15-6-4-7-16(12-15)14-22)23-28(25,26)20-11-5-9-17-8-2-3-10-18(17)20/h2-12,19,23H,13H2,1H3