9H-fluoren-9-ylmethyl 3-(2-methoxy-2-oxidanylidene-ethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: 9H-fluoren-9-ylmethyl 3-(2-methoxy-2-oxidanylidene-ethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: 9H-fluoren-9-ylmethyl 3-(2-methoxy-2-oxo-ethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 3-(2-methoxy-2-oxoethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid 9H-fluoren-9-ylmethyl ester IUPAC Name: 9H-fluoren-9-ylmethyl 3-(2-methoxy-2-oxoethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 3-(2-keto-2-methoxy-ethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid 9H-fluoren-9-ylmethyl ester Formula: C27H25NO4 MolecularWeight: 427.4917

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CC2=CC=CC=C2CN1C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

COC(=O)CC1CC2=CC=CC=C2CN1C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C27H25NO4/c1-31-26(29)15-20-14-18-8-2-3-9-19(18)16-28(20)27(30)32-17-25-23-12-6-4-10-21(23)22-11-5-7-13-24(22)25/h2-13,20,25H,14-17H2,1H3