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

Systemtic Name: 1-tert-butyl-7-(tert-butylamino)-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-tert-butyl-7-(tert-butylamino)-6-nitro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-tert-butyl-7-(tert-butylamino)-6-nitro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-tert-butyl-7-(tert-butylamino)-6-nitro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-tert-butyl-7-(tert-butylamino)-4-keto-6-nitro-quinoline-3-carboxylic acid Formula: C18H23N3O5 MolecularWeight: 361.39232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=C(C=C2C(=C1)N(C=C(C2=O)C(=O)O)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC1=C(C=C2C(=C1)N(C=C(C2=O)C(=O)O)C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O5/c1-17(2,3)19-12-8-13-10(7-14(12)21(25)26)15(22)11(16(23)24)9-20(13)18(4,5)6/h7-9,19H,1-6H3,(H,23,24)