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

Systemtic Name: dimethyl (1S,2R,10bR)-1-methyl-3-pyridin-2-yl-2,10b-dihydropyrazolo[5,1-a]isoquinoline-1,2-dicarboxylate Openeye Name: dimethyl (1S,2R,10bR)-1-methyl-3-(2-pyridyl)-2,10b-dihydropyrazolo[5,1-a]isoquinoline-1,2-dicarboxylate CAS Name: (1S,2R,10bR)-1-methyl-3-(2-pyridinyl)-2,10b-dihydropyrazolo[5,1-a]isoquinoline-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (1S,2R,10bR)-1-methyl-3-pyridin-2-yl-2,10b-dihydropyrazolo[5,1-a]isoquinoline-1,2-dicarboxylate Traditional Name: (1S,2R,10bR)-1-methyl-3-(2-pyridyl)-2,10b-dihydropyrazol[5,1-a]isoquinoline-1,2-dicarboxylic acid dimethyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2C3=CC=CC=C3C=CN2N(C1C(=O)OC)C4=CC=CC=N4)C(=O)OC

Isomeric SMILES

C[C@@]1([C@H]2C3=CC=CC=C3C=CN2N([C@H]1C(=O)OC)C4=CC=CC=N4)C(=O)OC

InChI

InChI=1S/C21H21N3O4/c1-21(20(26)28-3)17-15-9-5-4-8-14(15)11-13-23(17)24(18(21)19(25)27-2)16-10-6-7-12-22-16/h4-13,17-18H,1-3H3/t17-,18+,21+/m1/s1