1-tert-butyl-7-(cyclopropylamino)-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-tert-butyl-7-(cyclopropylamino)-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-tert-butyl-7-(cyclopropylamino)-6-nitro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-tert-butyl-7-(cyclopropylamino)-6-nitro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-tert-butyl-7-(cyclopropylamino)-6-nitro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-tert-butyl-7-(cyclopropylamino)-4-keto-6-nitro-quinoline-3-carboxylic acid Formula: C17H19N3O5 MolecularWeight: 345.34986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=O)C2=CC(=C(C=C21)NC3CC3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(C)(C)N1C=C(C(=O)C2=CC(=C(C=C21)NC3CC3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C17H19N3O5/c1-17(2,3)19-8-11(16(22)23)15(21)10-6-14(20(24)25)12(7-13(10)19)18-9-4-5-9/h6-9,18H,4-5H2,1-3H3,(H,22,23)