1-[5-azanyl-9-(butylamino)-3,3,8-trimethyl-6-oxidanyl-9-oxidanylidene-nonanoyl]-N-methyl-3,4-dihydro-2H-quinoline-3-carboxamide

Systemtic Name: 1-[5-azanyl-9-(butylamino)-3,3,8-trimethyl-6-oxidanyl-9-oxidanylidene-nonanoyl]-N-methyl-3,4-dihydro-2H-quinoline-3-carboxamide Openeye Name: 1-[5-amino-9-(butylamino)-6-hydroxy-3,3,8-trimethyl-9-oxo-nonanoyl]-N-methyl-3,4-dihydro-2H-quinoline-3-carboxamide CAS Name: 1-[5-amino-9-(butylamino)-6-hydroxy-3,3,8-trimethyl-1,9-dioxononyl]-N-methyl-3,4-dihydro-2H-quinoline-3-carboxamide IUPAC Name: 1-[5-amino-9-(butylamino)-6-hydroxy-3,3,8-trimethyl-9-oxononanoyl]-N-methyl-3,4-dihydro-2H-quinoline-3-carboxamide Traditional Name: 1-[5-amino-9-(butylamino)-6-hydroxy-9-keto-3,3,8-trimethyl-nonanoyl]-N-methyl-3,4-dihydro-2H-quinoline-3-carboxamide Formula: C27H44N4O4 MolecularWeight: 488.66266

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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)C(=O)NC)N)O

Isomeric SMILES

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

InChI

InChI=1S/C27H44N4O4/c1-6-7-12-30-25(34)18(2)13-23(32)21(28)15-27(3,4)16-24(33)31-17-20(26(35)29-5)14-19-10-8-9-11-22(19)31/h8-11,18,20-21,23,32H,6-7,12-17,28H2,1-5H3,(H,29,35)(H,30,34)