4-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]-2-methyl-quinoline-8-carboxylic acid

Systemtic Name: 4-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]-2-methyl-quinoline-8-carboxylic acid Openeye Name: 4-[(1,1-dioxothiolan-3-yl)-methyl-amino]-2-methyl-quinoline-8-carboxylic acid CAS Name: 4-[(1,1-dioxo-3-thiolanyl)-methylamino]-2-methyl-8-quinolinecarboxylic acid IUPAC Name: 4-[(1,1-dioxothiolan-3-yl)-methylamino]-2-methylquinoline-8-carboxylic acid Traditional Name: 4-[(1,1-diketothiolan-3-yl)-methyl-amino]-2-methyl-quinoline-8-carboxylic acid Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2C(=O)O)C(=C1)N(C)C3CCS(=O)(=O)C3

Isomeric SMILES

CC1=NC2=C(C=CC=C2C(=O)O)C(=C1)N(C)C3CCS(=O)(=O)C3

InChI

InChI=1S/C16H18N2O4S/c1-10-8-14(18(2)11-6-7-23(21,22)9-11)12-4-3-5-13(16(19)20)15(12)17-10/h3-5,8,11H,6-7,9H2,1-2H3,(H,19,20)