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

Systemtic Name: 1-cyclopropyl-7-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-8-methyl-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-8-methyl-6-nitro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-8-methyl-6-nitro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-8-methyl-6-nitro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-4-keto-8-methyl-6-nitro-quinoline-3-carboxylic acid Formula: C21H23N3O7 MolecularWeight: 429.42322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1N3CCC4(CC3)OCCO4)[N+](=O)[O-])C(=O)C(=CN2C5CC5)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1N3CCC4(CC3)OCCO4)[N+](=O)[O-])C(=O)C(=CN2C5CC5)C(=O)O

InChI

InChI=1S/C21H23N3O7/c1-12-17-14(19(25)15(20(26)27)11-23(17)13-2-3-13)10-16(24(28)29)18(12)22-6-4-21(5-7-22)30-8-9-31-21/h10-11,13H,2-9H2,1H3,(H,26,27)