1-cyclopropyl-8-methyl-6-nitro-4-oxidanylidene-7-thiomorpholin-4-yl-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-8-methyl-6-nitro-4-oxidanylidene-7-thiomorpholin-4-yl-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-8-methyl-6-nitro-4-oxo-7-thiomorpholino-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-8-methyl-6-nitro-4-oxo-7-thiomorpholin-4-yl-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-8-methyl-6-nitro-4-oxo-7-thiomorpholin-4-ylquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-4-keto-8-methyl-6-nitro-7-thiomorpholino-quinoline-3-carboxylic acid Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1N3CCSCC3)[N+](=O)[O-])C(=O)C(=CN2C4CC4)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1N3CCSCC3)[N+](=O)[O-])C(=O)C(=CN2C4CC4)C(=O)O

InChI

InChI=1S/C18H19N3O5S/c1-10-15-12(17(22)13(18(23)24)9-20(15)11-2-3-11)8-14(21(25)26)16(10)19-4-6-27-7-5-19/h8-9,11H,2-7H2,1H3,(H,23,24)