5-azanyl-N-butyl-2,7,7-trimethyl-9-(3-methylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)-4-oxidanyl-9-oxidanylidene-nonanamide

Systemtic Name: 5-azanyl-N-butyl-2,7,7-trimethyl-9-(3-methylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)-4-oxidanyl-9-oxidanylidene-nonanamide Openeye Name: 5-amino-N-butyl-4-hydroxy-2,7,7-trimethyl-9-(3-methylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)-9-oxo-nonanamide CAS Name: 5-amino-N-butyl-4-hydroxy-2,7,7-trimethyl-9-(3-methylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)-9-oxononanamide IUPAC Name: 5-amino-N-butyl-4-hydroxy-2,7,7-trimethyl-9-(3-methylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)-9-oxononanamide Traditional Name: 5-amino-N-butyl-4-hydroxy-9-keto-9-(3-mesyl-3,4-dihydro-2H-quinolin-1-yl)-2,7,7-trimethyl-pelargonamide Formula: C26H43N3O5S MolecularWeight: 509.70172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C)CC(C(CC(C)(C)CC(=O)N1CC(CC2=CC=CC=C21)S(=O)(=O)C)N)O

Isomeric SMILES

CCCCNC(=O)C(C)CC(C(CC(C)(C)CC(=O)N1CC(CC2=CC=CC=C21)S(=O)(=O)C)N)O

InChI

InChI=1S/C26H43N3O5S/c1-6-7-12-28-25(32)18(2)13-23(30)21(27)15-26(3,4)16-24(31)29-17-20(35(5,33)34)14-19-10-8-9-11-22(19)29/h8-11,18,20-21,23,30H,6-7,12-17,27H2,1-5H3,(H,28,32)