N-[4-[(4-acetamido-3-chloranyl-phenyl)amino]-4-oxidanylidene-butyl]adamantane-1-carboxamide

Systemtic Name: N-[4-[(4-acetamido-3-chloranyl-phenyl)amino]-4-oxidanylidene-butyl]adamantane-1-carboxamide Openeye Name: N-[4-(4-acetamido-3-chloro-anilino)-4-oxo-butyl]adamantane-1-carboxamide CAS Name: N-[4-(4-acetamido-3-chloroanilino)-4-oxobutyl]-1-adamantanecarboxamide IUPAC Name: N-[4-(4-acetamido-3-chloroanilino)-4-oxobutyl]adamantane-1-carboxamide Traditional Name: N-[4-(4-acetamido-3-chloro-anilino)-4-keto-butyl]adamantane-1-carboxamide Formula: C23H30ClN3O3 MolecularWeight: 431.9556

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)CCCNC(=O)C23CC4CC(C2)CC(C4)C3)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)CCCNC(=O)C23CC4CC(C2)CC(C4)C3)Cl

InChI

InChI=1S/C23H30ClN3O3/c1-14(28)26-20-5-4-18(10-19(20)24)27-21(29)3-2-6-25-22(30)23-11-15-7-16(12-23)9-17(8-15)13-23/h4-5,10,15-17H,2-3,6-9,11-13H2,1H3,(H,25,30)(H,26,28)(H,27,29)