(1R,2R)-2-oxidanyl-1-[[5-[(2-oxidanylidene-3,4-dihydro-1H-quinolin-7-yl)methylcarbamoyl]pyrazolo[1,5-a]pyrimidin-7-yl]carbonylamino]-2,3-dihydro-1H-indene-5-carboxylic acid

Systemtic Name: (1R,2R)-2-oxidanyl-1-[[5-[(2-oxidanylidene-3,4-dihydro-1H-quinolin-7-yl)methylcarbamoyl]pyrazolo[1,5-a]pyrimidin-7-yl]carbonylamino]-2,3-dihydro-1H-indene-5-carboxylic acid Openeye Name: (1R,2R)-2-hydroxy-1-[[5-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)methylcarbamoyl]pyrazolo[1,5-a]pyrimidine-7-carbonyl]amino]indane-5-carboxylic acid CAS Name: (1R,2R)-2-hydroxy-1-[[oxo-[5-[oxo-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)methylamino]methyl]-7-pyrazolo[1,5-a]pyrimidinyl]methyl]amino]-2,3-dihydro-1H-indene-5-carboxylic acid IUPAC Name: (1R,2R)-2-hydroxy-1-[[5-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)methylcarbamoyl]pyrazolo[1,5-a]pyrimidine-7-carbonyl]amino]-2,3-dihydro-1H-indene-5-carboxylic acid Traditional Name: (1R,2R)-2-hydroxy-1-[[5-[(2-keto-3,4-dihydro-1H-quinolin-7-yl)methylcarbamoyl]pyrazolo[1,5-a]pyrimidine-7-carbonyl]amino]indane-5-carboxylic acid Formula: C28H24N6O6 MolecularWeight: 540.52676

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC2=C1C=CC(=C2)CNC(=O)C3=NC4=CC=NN4C(=C3)C(=O)NC5C(CC6=C5C=CC(=C6)C(=O)O)O

Isomeric SMILES

C1CC(=O)NC2=C1C=CC(=C2)CNC(=O)C3=NC4=CC=NN4C(=C3)C(=O)N[C@H]5[C@@H](CC6=C5C=CC(=C6)C(=O)O)O

InChI

InChI=1S/C28H24N6O6/c35-22-11-17-10-16(28(39)40)3-5-18(17)25(22)33-27(38)21-12-20(31-23-7-8-30-34(21)23)26(37)29-13-14-1-2-15-4-6-24(36)32-19(15)9-14/h1-3,5,7-10,12,22,25,35H,4,6,11,13H2,(H,29,37)(H,32,36)(H,33,38)(H,39,40)/t22-,25-/m1/s1