N-[3-[2-[4-(4-chloranyl-2-methyl-phenoxy)butanoyl]hydrazinyl]-3-oxidanylidene-propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[2-[4-(4-chloranyl-2-methyl-phenoxy)butanoyl]hydrazinyl]-3-oxidanylidene-propyl]adamantane-1-carboxamide Openeye Name: N-[3-[2-[4-(4-chloro-2-methyl-phenoxy)butanoyl]hydrazino]-3-oxo-propyl]adamantane-1-carboxamide CAS Name: N-[3-[[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]hydrazo]-3-oxopropyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[2-[4-(4-chloro-2-methylphenoxy)butanoyl]hydrazinyl]-3-oxopropyl]adamantane-1-carboxamide Traditional Name: N-[3-[N'-[4-(4-chloro-2-methyl-phenoxy)butanoyl]hydrazino]-3-keto-propyl]adamantane-1-carboxamide Formula: C25H34ClN3O4 MolecularWeight: 476.00816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NNC(=O)CCNC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NNC(=O)CCNC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C25H34ClN3O4/c1-16-9-20(26)4-5-21(16)33-8-2-3-22(30)28-29-23(31)6-7-27-24(32)25-13-17-10-18(14-25)12-19(11-17)15-25/h4-5,9,17-19H,2-3,6-8,10-15H2,1H3,(H,27,32)(H,28,30)(H,29,31)