N-cyclopropyl-1-[3-[1-oxidanidyl-3-(2-oxidanylpropan-2-yl)pyridin-1-ium-4-yl]phenyl]-4-oxidanylidene-1,8-naphthyridine-3-carboxamide

Systemtic Name: N-cyclopropyl-1-[3-[1-oxidanidyl-3-(2-oxidanylpropan-2-yl)pyridin-1-ium-4-yl]phenyl]-4-oxidanylidene-1,8-naphthyridine-3-carboxamide Openeye Name: N-cyclopropyl-1-[3-[3-(1-hydroxy-1-methyl-ethyl)-1-oxido-pyridin-1-ium-4-yl]phenyl]-4-oxo-1,8-naphthyridine-3-carboxamide CAS Name: N-cyclopropyl-1-[3-[3-(2-hydroxypropan-2-yl)-1-oxido-4-pyridin-1-iumyl]phenyl]-4-oxo-1,8-naphthyridine-3-carboxamide IUPAC Name: N-cyclopropyl-1-[3-[3-(2-hydroxypropan-2-yl)-1-oxidopyridin-1-ium-4-yl]phenyl]-4-oxo-1,8-naphthyridine-3-carboxamide Traditional Name: N-cyclopropyl-1-[3-[3-(1-hydroxy-1-methyl-ethyl)-1-oxido-pyridin-1-ium-4-yl]phenyl]-4-keto-1,8-naphthyridine-3-carboxamide Formula: C26H24N4O4 MolecularWeight: 456.49316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=C(C=C[N+](=C1)[O-])C2=CC(=CC=C2)N3C=C(C(=O)C4=C3N=CC=C4)C(=O)NC5CC5)O

Isomeric SMILES

CC(C)(C1=C(C=C[N+](=C1)[O-])C2=CC(=CC=C2)N3C=C(C(=O)C4=C3N=CC=C4)C(=O)NC5CC5)O

InChI

InChI=1S/C26H24N4O4/c1-26(2,33)22-15-29(34)12-10-19(22)16-5-3-6-18(13-16)30-14-21(25(32)28-17-8-9-17)23(31)20-7-4-11-27-24(20)30/h3-7,10-15,17,33H,8-9H2,1-2H3,(H,28,32)