prop-2-ynyl 2-methyl-5-phenyl-3,4,6,7,8,8a-hexahydro-1H-isoquinoline-8-carboxylate

Systemtic Name: prop-2-ynyl 2-methyl-5-phenyl-3,4,6,7,8,8a-hexahydro-1H-isoquinoline-8-carboxylate Openeye Name: prop-2-ynyl 2-methyl-5-phenyl-3,4,6,7,8,8a-hexahydro-1H-isoquinoline-8-carboxylate CAS Name: 2-methyl-5-phenyl-3,4,6,7,8,8a-hexahydro-1H-isoquinoline-8-carboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 2-methyl-5-phenyl-3,4,6,7,8,8a-hexahydro-1H-isoquinoline-8-carboxylate Traditional Name: 2-methyl-5-phenyl-3,4,6,7,8,8a-hexahydro-1H-isoquinoline-8-carboxylic acid propargyl ester Formula: C20H23NO2 MolecularWeight: 309.40212

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(CCC(C2C1)C(=O)OCC#C)C3=CC=CC=C3

Isomeric SMILES

CN1CCC2=C(CCC(C2C1)C(=O)OCC#C)C3=CC=CC=C3

InChI

InChI=1S/C20H23NO2/c1-3-13-23-20(22)18-10-9-16(15-7-5-4-6-8-15)17-11-12-21(2)14-19(17)18/h1,4-8,18-19H,9-14H2,2H3