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

Systemtic Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxy-ethanone Openeye Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(6-morpholinosulfonylbenzotriazol-1-yl)oxy-ethanone CAS Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[[6-(4-morpholinylsulfonyl)-1-benzotriazolyl]oxy]ethanone IUPAC Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxyethanone Traditional Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(6-morpholinosulfonylbenzotriazol-1-yl)oxy-ethanone Formula: C21H23N5O5S MolecularWeight: 457.50282

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C(=O)CON3C4=C(C=CC(=C4)S(=O)(=O)N5CCOCC5)N=N3

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C(=O)CON3C4=C(C=CC(=C4)S(=O)(=O)N5CCOCC5)N=N3

InChI

InChI=1S/C21H23N5O5S/c27-21(25-9-3-5-16-4-1-2-6-19(16)25)15-31-26-20-14-17(7-8-18(20)22-23-26)32(28,29)24-10-12-30-13-11-24/h1-2,4,6-8,14H,3,5,9-13,15H2