dimethyl (1S,2R)-3-phenyl-2,10b-dihydro-1H-pyrazolo[5,1-a]isoquinoline-1,2-dicarboxylate

Systemtic Name: dimethyl (1S,2R)-3-phenyl-2,10b-dihydro-1H-pyrazolo[5,1-a]isoquinoline-1,2-dicarboxylate Openeye Name: dimethyl (1S,2R)-3-phenyl-2,10b-dihydro-1H-pyrazolo[5,1-a]isoquinoline-1,2-dicarboxylate CAS Name: (1S,2R)-3-phenyl-2,10b-dihydro-1H-pyrazolo[5,1-a]isoquinoline-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (1S,2R)-3-phenyl-2,10b-dihydro-1H-pyrazolo[5,1-a]isoquinoline-1,2-dicarboxylate Traditional Name: (1S,2R)-3-phenyl-2,10b-dihydro-1H-pyrazol[5,1-a]isoquinoline-1,2-dicarboxylic acid dimethyl ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C2C3=CC=CC=C3C=CN2N(C1C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@@H]1[C@@H](N(N2C1C3=CC=CC=C3C=C2)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C21H20N2O4/c1-26-20(24)17-18-16-11-7-6-8-14(16)12-13-22(18)23(19(17)21(25)27-2)15-9-4-3-5-10-15/h3-13,17-19H,1-2H3/t17-,18?,19+/m0/s1