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

Systemtic Name: ethyl 4-[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)carbonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-(1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carbonyl)piperazine-1-carboxylate CAS Name: 4-[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(1-mesyl-3,4-dihydro-2H-quinoline-6-carbonyl)piperazine-1-carboxylic acid ethyl ester Formula: C18H25N3O5S MolecularWeight: 395.4732

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O5S/c1-3-26-18(23)20-11-9-19(10-12-20)17(22)15-6-7-16-14(13-15)5-4-8-21(16)27(2,24)25/h6-7,13H,3-5,8-12H2,1-2H3