1-tert-butyl-7-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-8-methyl-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-tert-butyl-7-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-8-methyl-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-tert-butyl-7-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-8-methyl-6-nitro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-tert-butyl-7-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-8-methyl-6-nitro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-tert-butyl-7-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-8-methyl-6-nitro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-tert-butyl-7-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-4-keto-8-methyl-6-nitro-quinoline-3-carboxylic acid Formula: C22H27N3O7 MolecularWeight: 445.46568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1N3CCC4(CC3)OCCO4)[N+](=O)[O-])C(=O)C(=CN2C(C)(C)C)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1N3CCC4(CC3)OCCO4)[N+](=O)[O-])C(=O)C(=CN2C(C)(C)C)C(=O)O

InChI

InChI=1S/C22H27N3O7/c1-13-17-14(19(26)15(20(27)28)12-24(17)21(2,3)4)11-16(25(29)30)18(13)23-7-5-22(6-8-23)31-9-10-32-22/h11-12H,5-10H2,1-4H3,(H,27,28)