N-(5-tert-butyl-2-oxidanyl-phenyl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: N-(5-tert-butyl-2-oxidanyl-phenyl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-(5-tert-butyl-2-hydroxy-phenyl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-(5-tert-butyl-2-hydroxyphenyl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-(5-tert-butyl-2-hydroxyphenyl)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: N-(5-tert-butyl-2-hydroxy-phenyl)-1-mesyl-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

InChI

InChI=1S/C21H26N2O4S/c1-21(2,3)16-8-10-19(24)17(13-16)22-20(25)15-7-9-18-14(12-15)6-5-11-23(18)28(4,26)27/h7-10,12-13,24H,5-6,11H2,1-4H3,(H,22,25)