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(3S)-2-ethoxycarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate

(3S)-2-ethoxycarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name:(3S)-2-ethoxycarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate
Openeye Name:(3S)-2-ethoxycarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate
CAS Name:(3S)-2-ethoxycarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate
IUPAC Name:(3S)-2-ethoxycarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate
Traditional Name:(3S)-2-carbethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylate
Formula: C13H14NO4-
MolecularWeight: 248.25456
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CC2=CC=CC=C2CC1C(=O)[O-]


Isomeric SMILES

CCOC(=O)N1CC2=CC=CC=C2C[C@H]1C(=O)[O-]


InChI

InChI=1S/C13H15NO4/c1-2-18-13(17)14-8-10-6-4-3-5-9(10)7-11(14)12(15)16/h3-6,11H,2,7-8H2,1H3,(H,15,16)/p-1/t11-/m0/s1


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