3-chloranyl-N-[4-[(4-methoxyphenyl)carbamoyl]phenyl]adamantane-1-carboxamide

Systemtic Name: 3-chloranyl-N-[4-[(4-methoxyphenyl)carbamoyl]phenyl]adamantane-1-carboxamide Openeye Name: 3-chloro-N-[4-[(4-methoxyphenyl)carbamoyl]phenyl]adamantane-1-carboxamide CAS Name: 3-chloro-N-[4-[(4-methoxyanilino)-oxomethyl]phenyl]-1-adamantanecarboxamide IUPAC Name: 3-chloro-N-[4-[(4-methoxyphenyl)carbamoyl]phenyl]adamantane-1-carboxamide Traditional Name: 3-chloro-N-[4-[(4-methoxyphenyl)carbamoyl]phenyl]adamantane-1-carboxamide Formula: C25H27ClN2O3 MolecularWeight: 438.94648

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)(C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)(C4)Cl

InChI

InChI=1S/C25H27ClN2O3/c1-31-21-8-6-19(7-9-21)27-22(29)18-2-4-20(5-3-18)28-23(30)24-11-16-10-17(12-24)14-25(26,13-16)15-24/h2-9,16-17H,10-15H2,1H3,(H,27,29)(H,28,30)