prop-2-enyl (5S,6S,8S)-5-(dimethoxymethyl)-6-ethoxy-8-(2-phenylselanylethylamino)-3,4,5,6,7,8-hexahydro-1H-isoquinoline-2-carboxylate

Systemtic Name: prop-2-enyl (5S,6S,8S)-5-(dimethoxymethyl)-6-ethoxy-8-(2-phenylselanylethylamino)-3,4,5,6,7,8-hexahydro-1H-isoquinoline-2-carboxylate Openeye Name: allyl (5S,6S,8S)-5-(dimethoxymethyl)-6-ethoxy-8-(2-phenylselanylethylamino)-3,4,5,6,7,8-hexahydro-1H-isoquinoline-2-carboxylate CAS Name: (5S,6S,8S)-5-(dimethoxymethyl)-6-ethoxy-8-[2-(phenylseleno)ethylamino]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-2-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (5S,6S,8S)-5-(dimethoxymethyl)-6-ethoxy-8-(2-phenylselanylethylamino)-3,4,5,6,7,8-hexahydro-1H-isoquinoline-2-carboxylate Traditional Name: (5S,6S,8S)-5-(dimethoxymethyl)-6-ethoxy-8-[2-(phenylseleno)ethylamino]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-2-carboxylic acid allyl ester Formula: C26H38N2O5Se MolecularWeight: 537.55032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CC(C2=C(C1C(OC)OC)CCN(C2)C(=O)OCC=C)NCC[Se]C3=CC=CC=C3

Isomeric SMILES

CCO[C@H]1C[C@@H](C2=C([C@@H]1C(OC)OC)CCN(C2)C(=O)OCC=C)NCC[Se]C3=CC=CC=C3

InChI

InChI=1S/C26H38N2O5Se/c1-5-15-33-26(29)28-14-12-20-21(18-28)22(27-13-16-34-19-10-8-7-9-11-19)17-23(32-6-2)24(20)25(30-3)31-4/h5,7-11,22-25,27H,1,6,12-18H2,2-4H3/t22-,23-,24-/m0/s1