methyl 2-[(5-azanylquinolin-8-yl)methylsulfonyl]ethanoate

Systemtic Name: methyl 2-[(5-azanylquinolin-8-yl)methylsulfonyl]ethanoate Openeye Name: methyl 2-[(5-amino-8-quinolyl)methylsulfonyl]acetate CAS Name: 2-[(5-amino-8-quinolinyl)methylsulfonyl]acetic acid methyl ester IUPAC Name: methyl 2-[(5-aminoquinolin-8-yl)methylsulfonyl]acetate Traditional Name: 2-[(5-amino-8-quinolyl)methylsulfonyl]acetic acid methyl ester Formula: C13H14N2O4S MolecularWeight: 294.32626

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CS(=O)(=O)CC1=C2C(=C(C=C1)N)C=CC=N2

Isomeric SMILES

COC(=O)CS(=O)(=O)CC1=C2C(=C(C=C1)N)C=CC=N2

InChI

InChI=1S/C13H14N2O4S/c1-19-12(16)8-20(17,18)7-9-4-5-11(14)10-3-2-6-15-13(9)10/h2-6H,7-8,14H2,1H3