ethyl (2S,4aR)-4-methyl-3,4a,5,6-tetrahydro-2H-benzo[f]quinoline-2-carboxylate

Systemtic Name: ethyl (2S,4aR)-4-methyl-3,4a,5,6-tetrahydro-2H-benzo[f]quinoline-2-carboxylate Openeye Name: ethyl (2S,4aR)-4-methyl-3,4a,5,6-tetrahydro-2H-benzo[f]quinoline-2-carboxylate CAS Name: (2S,4aR)-4-methyl-3,4a,5,6-tetrahydro-2H-benzo[f]quinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl (2S,4aR)-4-methyl-3,4a,5,6-tetrahydro-2H-benzo[f]quinoline-2-carboxylate Traditional Name: (2S,4aR)-4-methyl-3,4a,5,6-tetrahydro-2H-benzo[f]quinoline-2-carboxylic acid ethyl ester Formula: C17H21NO2 MolecularWeight: 271.35414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CN(C2CCC3=CC=CC=C3C2=C1)C

Isomeric SMILES

CCOC(=O)[C@@H]1CN([C@@H]2CCC3=CC=CC=C3C2=C1)C

InChI

InChI=1S/C17H21NO2/c1-3-20-17(19)13-10-15-14-7-5-4-6-12(14)8-9-16(15)18(2)11-13/h4-7,10,13,16H,3,8-9,11H2,1-2H3/t13-,16+/m0/s1