3-chloranyl-N-(2-methyl-6-propan-2-yl-phenyl)adamantane-1-carboxamide

Systemtic Name: 3-chloranyl-N-(2-methyl-6-propan-2-yl-phenyl)adamantane-1-carboxamide Openeye Name: 3-chloro-N-(2-isopropyl-6-methyl-phenyl)adamantane-1-carboxamide CAS Name: 3-chloro-N-(2-methyl-6-propan-2-ylphenyl)-1-adamantanecarboxamide IUPAC Name: 3-chloro-N-(2-methyl-6-propan-2-ylphenyl)adamantane-1-carboxamide Traditional Name: 3-chloro-N-(2-isopropyl-6-methyl-phenyl)adamantane-1-carboxamide Formula: C21H28ClNO MolecularWeight: 345.90612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)C23CC4CC(C2)CC(C4)(C3)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)C23CC4CC(C2)CC(C4)(C3)Cl

InChI

InChI=1S/C21H28ClNO/c1-13(2)17-6-4-5-14(3)18(17)23-19(24)20-8-15-7-16(9-20)11-21(22,10-15)12-20/h4-6,13,15-16H,7-12H2,1-3H3,(H,23,24)