1-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxy-ethanone

Systemtic Name: 1-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxy-ethanone Openeye Name: 1-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(6-morpholinosulfonylbenzotriazol-1-yl)oxy-ethanone CAS Name: 1-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-[[6-(4-morpholinylsulfonyl)-1-benzotriazolyl]oxy]ethanone IUPAC Name: 1-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxyethanone Traditional Name: 1-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(6-morpholinosulfonylbenzotriazol-1-yl)oxy-ethanone Formula: C22H25N5O5S MolecularWeight: 471.5294

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=CC=CC=C2N1C(=O)CON3C4=C(C=CC(=C4)S(=O)(=O)N5CCOCC5)N=N3

Isomeric SMILES

CC1CCC2=CC=CC=C2N1C(=O)CON3C4=C(C=CC(=C4)S(=O)(=O)N5CCOCC5)N=N3

InChI

InChI=1S/C22H25N5O5S/c1-16-6-7-17-4-2-3-5-20(17)26(16)22(28)15-32-27-21-14-18(8-9-19(21)23-24-27)33(29,30)25-10-12-31-13-11-25/h2-5,8-9,14,16H,6-7,10-13,15H2,1H3