1-cyclopropyl-8-[(3S,4R)-3-cyclopropyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidin-1-yl]-7-fluoranyl-9-methyl-4-oxidanylidene-quinolizine-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-8-[(3S,4R)-3-cyclopropyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidin-1-yl]-7-fluoranyl-9-methyl-4-oxidanylidene-quinolizine-3-carboxylic acid Openeye Name: 8-[(3R,4S)-3-(tert-butoxycarbonylamino)-4-cyclopropyl-pyrrolidin-1-yl]-1-cyclopropyl-7-fluoro-9-methyl-4-oxo-quinolizine-3-carboxylic acid CAS Name: 1-cyclopropyl-8-[(3S,4R)-3-cyclopropyl-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-pyrrolidinyl]-7-fluoro-9-methyl-4-oxo-3-quinolizinecarboxylic acid IUPAC Name: 1-cyclopropyl-8-[(3S,4R)-3-cyclopropyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidin-1-yl]-7-fluoro-9-methyl-4-oxoquinolizine-3-carboxylic acid Traditional Name: 8-[(3R,4S)-3-(tert-butoxycarbonylamino)-4-cyclopropyl-pyrrolidino]-1-cyclopropyl-7-fluoro-4-keto-9-methyl-quinolizine-3-carboxylic acid Formula: C26H32FN3O5 MolecularWeight: 485.547783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CN2C1=C(C=C(C2=O)C(=O)O)C3CC3)F)N4CC(C(C4)NC(=O)OC(C)(C)C)C5CC5

Isomeric SMILES

CC1=C(C(=CN2C1=C(C=C(C2=O)C(=O)O)C3CC3)F)N4C[C@@H]([C@H](C4)NC(=O)OC(C)(C)C)C5CC5

InChI

InChI=1S/C26H32FN3O5/c1-13-21-16(14-5-6-14)9-17(24(32)33)23(31)30(21)11-19(27)22(13)29-10-18(15-7-8-15)20(12-29)28-25(34)35-26(2,3)4/h9,11,14-15,18,20H,5-8,10,12H2,1-4H3,(H,28,34)(H,32,33)/t18-,20+/m1/s1