1-[3-[2-[1-oxidanidyl-5-(2-oxidanylpropan-2-yl)pyridin-1-ium-3-yl]ethynyl]phenyl]-4-oxidanylidene-N-propan-2-yl-1,8-naphthyridine-3-carboxamide

Systemtic Name: 1-[3-[2-[1-oxidanidyl-5-(2-oxidanylpropan-2-yl)pyridin-1-ium-3-yl]ethynyl]phenyl]-4-oxidanylidene-N-propan-2-yl-1,8-naphthyridine-3-carboxamide Openeye Name: 1-[3-[2-[5-(1-hydroxy-1-methyl-ethyl)-1-oxido-pyridin-1-ium-3-yl]ethynyl]phenyl]-N-isopropyl-4-oxo-1,8-naphthyridine-3-carboxamide CAS Name: 1-[3-[2-[5-(2-hydroxypropan-2-yl)-1-oxido-3-pyridin-1-iumyl]ethynyl]phenyl]-4-oxo-N-propan-2-yl-1,8-naphthyridine-3-carboxamide IUPAC Name: 1-[3-[2-[5-(2-hydroxypropan-2-yl)-1-oxidopyridin-1-ium-3-yl]ethynyl]phenyl]-4-oxo-N-propan-2-yl-1,8-naphthyridine-3-carboxamide Traditional Name: 1-[3-[2-[5-(1-hydroxy-1-methyl-ethyl)-1-oxido-pyridin-1-ium-3-yl]ethynyl]phenyl]-N-isopropyl-4-keto-1,8-naphthyridine-3-carboxamide Formula: C28H26N4O4 MolecularWeight: 482.53044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CN(C2=C(C1=O)C=CC=N2)C3=CC=CC(=C3)C#CC4=CC(=C[N+](=C4)[O-])C(C)(C)O

Isomeric SMILES

CC(C)NC(=O)C1=CN(C2=C(C1=O)C=CC=N2)C3=CC=CC(=C3)C#CC4=CC(=C[N+](=C4)[O-])C(C)(C)O

InChI

InChI=1S/C28H26N4O4/c1-18(2)30-27(34)24-17-32(26-23(25(24)33)9-6-12-29-26)22-8-5-7-19(14-22)10-11-20-13-21(28(3,4)35)16-31(36)15-20/h5-9,12-18,35H,1-4H3,(H,30,34)