ethyl 4-[1-[methanoyl(oxidanyl)amino]-2-(quinolin-3-ylmethylsulfonyl)ethyl]benzoate

Systemtic Name: ethyl 4-[1-[methanoyl(oxidanyl)amino]-2-(quinolin-3-ylmethylsulfonyl)ethyl]benzoate Openeye Name: ethyl 4-[1-[formyl(hydroxy)amino]-2-(3-quinolylmethylsulfonyl)ethyl]benzoate CAS Name: 4-[1-[formyl(hydroxy)amino]-2-(3-quinolinylmethylsulfonyl)ethyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[1-[formyl(hydroxy)amino]-2-(quinolin-3-ylmethylsulfonyl)ethyl]benzoate Traditional Name: 4-[1-[formyl(hydroxy)amino]-2-(3-quinolylmethylsulfonyl)ethyl]benzoic acid ethyl ester Formula: C22H22N2O6S MolecularWeight: 442.48488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C(CS(=O)(=O)CC2=CC3=CC=CC=C3N=C2)N(C=O)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C(CS(=O)(=O)CC2=CC3=CC=CC=C3N=C2)N(C=O)O

InChI

InChI=1S/C22H22N2O6S/c1-2-30-22(26)18-9-7-17(8-10-18)21(24(27)15-25)14-31(28,29)13-16-11-19-5-3-4-6-20(19)23-12-16/h3-12,15,21,27H,2,13-14H2,1H3