dimethyl (1S,2R,10bR)-1-methyl-3-phenyl-2,10b-dihydropyrazolo[5,1-a]isoquinoline-1,2-dicarboxylate

Systemtic Name: dimethyl (1S,2R,10bR)-1-methyl-3-phenyl-2,10b-dihydropyrazolo[5,1-a]isoquinoline-1,2-dicarboxylate Openeye Name: dimethyl (1S,2R,10bR)-1-methyl-3-phenyl-2,10b-dihydropyrazolo[5,1-a]isoquinoline-1,2-dicarboxylate CAS Name: (1S,2R,10bR)-1-methyl-3-phenyl-2,10b-dihydropyrazolo[5,1-a]isoquinoline-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (1S,2R,10bR)-1-methyl-3-phenyl-2,10b-dihydropyrazolo[5,1-a]isoquinoline-1,2-dicarboxylate Traditional Name: (1S,2R,10bR)-1-methyl-3-phenyl-2,10b-dihydropyrazol[5,1-a]isoquinoline-1,2-dicarboxylic acid dimethyl ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2C3=CC=CC=C3C=CN2N(C1C(=O)OC)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

C[C@@]1([C@H]2C3=CC=CC=C3C=CN2N([C@H]1C(=O)OC)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C22H22N2O4/c1-22(21(26)28-3)18-17-12-8-7-9-15(17)13-14-23(18)24(19(22)20(25)27-2)16-10-5-4-6-11-16/h4-14,18-19H,1-3H3/t18-,19+,22+/m1/s1