ethyl 1-tert-butyl-7-[(2R,4R)-4-[[(1S,4R)-7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl]methylsulfonylamino]-2-methyl-pyrrolidin-1-yl]-6-fluoranyl-4-oxidanylidene-1,8-naphthyridine-3-carboxylate

Systemtic Name: ethyl 1-tert-butyl-7-[(2R,4R)-4-[[(1S,4R)-7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl]methylsulfonylamino]-2-methyl-pyrrolidin-1-yl]-6-fluoranyl-4-oxidanylidene-1,8-naphthyridine-3-carboxylate Openeye Name: ethyl 1-tert-butyl-7-[(2R,4R)-4-[[(1R,4S)-7,7-dimethyl-2-oxo-norbornan-1-yl]methylsulfonylamino]-2-methyl-pyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylate CAS Name: 1-tert-butyl-7-[(2R,4R)-4-[[(1S,4R)-7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl]methylsulfonylamino]-2-methyl-1-pyrrolidinyl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-tert-butyl-7-[(2R,4R)-4-[[(1S,4R)-7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl]methylsulfonylamino]-2-methylpyrrolidin-1-yl]-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylate Traditional Name: 1-tert-butyl-6-fluoro-4-keto-7-[(2R,4R)-4-[[(1R,4S)-2-keto-7,7-dimethyl-norbornan-1-yl]methylsulfonylamino]-2-methyl-pyrrolidino]-1,8-naphthyridine-3-carboxylic acid ethyl ester Formula: C30H41FN4O6S MolecularWeight: 604.733143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=NC(=C(C=C2C1=O)F)N3CC(CC3C)NS(=O)(=O)CC45CCC(C4(C)C)CC5=O)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=NC(=C(C=C2C1=O)F)N3C[C@@H](C[C@H]3C)NS(=O)(=O)C[C@]45CC[C@H](C4(C)C)CC5=O)C(C)(C)C

InChI

InChI=1S/C30H41FN4O6S/c1-8-41-27(38)21-15-35(28(3,4)5)25-20(24(21)37)13-22(31)26(32-25)34-14-19(11-17(34)2)33-42(39,40)16-30-10-9-18(12-23(30)36)29(30,6)7/h13,15,17-19,33H,8-12,14,16H2,1-7H3/t17-,18+,19-,30+/m1/s1