diethyl (3S)-5-oxidanylidene-2,3-dihydro-1H-pyrrolo[1,2-b]isoquinoline-3,10-dicarboxylate

Systemtic Name: diethyl (3S)-5-oxidanylidene-2,3-dihydro-1H-pyrrolo[1,2-b]isoquinoline-3,10-dicarboxylate Openeye Name: diethyl (3S)-5-oxo-2,3-dihydro-1H-pyrrolo[1,2-b]isoquinoline-3,10-dicarboxylate CAS Name: (3S)-5-oxo-2,3-dihydro-1H-pyrrolo[1,2-b]isoquinoline-3,10-dicarboxylic acid diethyl ester IUPAC Name: diethyl (3S)-5-oxo-2,3-dihydro-1H-pyrrolo[1,2-b]isoquinoline-3,10-dicarboxylate Traditional Name: (3S)-5-keto-2,3-dihydro-1H-pyrrol[1,2-b]isoquinoline-3,10-dicarboxylic acid diethyl ester Formula: C18H19NO5 MolecularWeight: 329.34716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC2=C(C3=CC=CC=C3C(=O)N12)C(=O)OCC

Isomeric SMILES

CCOC(=O)[C@@H]1CCC2=C(C3=CC=CC=C3C(=O)N12)C(=O)OCC

InChI

InChI=1S/C18H19NO5/c1-3-23-17(21)14-10-9-13-15(18(22)24-4-2)11-7-5-6-8-12(11)16(20)19(13)14/h5-8,14H,3-4,9-10H2,1-2H3/t14-/m0/s1