methyl 3-[ethylsulfonyl(pyridin-3-ylmethyl)amino]benzoate

Systemtic Name: methyl 3-[ethylsulfonyl(pyridin-3-ylmethyl)amino]benzoate Openeye Name: methyl 3-[ethylsulfonyl(3-pyridylmethyl)amino]benzoate CAS Name: 3-[ethylsulfonyl(3-pyridinylmethyl)amino]benzoic acid methyl ester IUPAC Name: methyl 3-[ethylsulfonyl(pyridin-3-ylmethyl)amino]benzoate Traditional Name: 3-[esyl(3-pyridylmethyl)amino]benzoic acid methyl ester Formula: C16H18N2O4S MolecularWeight: 334.39012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N(CC1=CN=CC=C1)C2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CCS(=O)(=O)N(CC1=CN=CC=C1)C2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C16H18N2O4S/c1-3-23(20,21)18(12-13-6-5-9-17-11-13)15-8-4-7-14(10-15)16(19)22-2/h4-11H,3,12H2,1-2H3