N-methyl-3-[methyl-[5-methylhexanoyl(oxidanyl)carbamoyl]amino]-2-oxidanyl-adamantane-1-carboxamide

Systemtic Name: N-methyl-3-[methyl-[5-methylhexanoyl(oxidanyl)carbamoyl]amino]-2-oxidanyl-adamantane-1-carboxamide Openeye Name: 2-hydroxy-3-[[hydroxy(5-methylhexanoyl)carbamoyl]-methyl-amino]-N-methyl-adamantane-1-carboxamide CAS Name: 2-hydroxy-3-[[[hydroxy-(5-methyl-1-oxohexyl)amino]-oxomethyl]-methylamino]-N-methyl-1-adamantanecarboxamide IUPAC Name: 2-hydroxy-3-[[hydroxy(5-methylhexanoyl)carbamoyl]-methylamino]-N-methyladamantane-1-carboxamide Traditional Name: 2-hydroxy-3-[[hydroxy(5-methylhexanoyl)carbamoyl]-methyl-amino]-N-methyl-adamantane-1-carboxamide Formula: C21H35N3O5 MolecularWeight: 409.5197

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(=O)N(C(=O)N(C)C12CC3CC(C1)CC(C3)(C2O)C(=O)NC)O

Isomeric SMILES

CC(C)CCCC(=O)N(C(=O)N(C)C12CC3CC(C1)CC(C3)(C2O)C(=O)NC)O

InChI

InChI=1S/C21H35N3O5/c1-13(2)6-5-7-16(25)24(29)19(28)23(4)21-11-14-8-15(12-21)10-20(9-14,17(21)26)18(27)22-3/h13-15,17,26,29H,5-12H2,1-4H3,(H,22,27)