1-tert-butyl-7-[4-(5-chloranyl-2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]-6-nitro-4-oxidanylidene-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 1-tert-butyl-7-[4-(5-chloranyl-2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]-6-nitro-4-oxidanylidene-1,8-naphthyridine-3-carboxylic acid Openeye Name: 1-tert-butyl-7-[4-(5-chloro-2-oxo-3H-benzimidazol-1-yl)-1-piperidyl]-6-nitro-4-oxo-1,8-naphthyridine-3-carboxylic acid CAS Name: 1-tert-butyl-7-[4-(5-chloro-2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]-6-nitro-4-oxo-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 1-tert-butyl-7-[4-(5-chloro-2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]-6-nitro-4-oxo-1,8-naphthyridine-3-carboxylic acid Traditional Name: 1-tert-butyl-7-[4-(5-chloro-2-keto-3H-benzimidazol-1-yl)piperidino]-4-keto-6-nitro-1,8-naphthyridine-3-carboxylic acid Formula: C25H25ClN6O6 MolecularWeight: 540.9556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=O)C2=CC(=C(N=C21)N3CCC(CC3)N4C5=C(C=C(C=C5)Cl)NC4=O)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(C)(C)N1C=C(C(=O)C2=CC(=C(N=C21)N3CCC(CC3)N4C5=C(C=C(C=C5)Cl)NC4=O)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C25H25ClN6O6/c1-25(2,3)30-12-16(23(34)35)20(33)15-11-19(32(37)38)22(28-21(15)30)29-8-6-14(7-9-29)31-18-5-4-13(26)10-17(18)27-24(31)36/h4-5,10-12,14H,6-9H2,1-3H3,(H,27,36)(H,34,35)