ethyl 4-[(1-ethylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)carbonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(1-ethylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)carbonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-(1-ethylsulfonyl-3,4-dihydro-2H-quinoline-6-carbonyl)piperazine-1-carboxylate CAS Name: 4-[(1-ethylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1-ethylsulfonyl-3,4-dihydro-2H-quinoline-6-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(1-esyl-3,4-dihydro-2H-quinoline-6-carbonyl)piperazine-1-carboxylic acid ethyl ester Formula: C19H27N3O5S MolecularWeight: 409.49978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)CC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)CC

InChI

InChI=1S/C19H27N3O5S/c1-3-27-19(24)21-12-10-20(11-13-21)18(23)16-7-8-17-15(14-16)6-5-9-22(17)28(25,26)4-2/h7-8,14H,3-6,9-13H2,1-2H3