N-[4-(1-adamantyl)phenyl]-5,6-bis(chloranyl)pyridine-3-carboxamide

Systemtic Name: N-[4-(1-adamantyl)phenyl]-5,6-bis(chloranyl)pyridine-3-carboxamide Openeye Name: N-[4-(1-adamantyl)phenyl]-5,6-dichloro-pyridine-3-carboxamide CAS Name: N-[4-(1-adamantyl)phenyl]-5,6-dichloro-3-pyridinecarboxamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-5,6-dichloropyridine-3-carboxamide Traditional Name: N-[4-(1-adamantyl)phenyl]-5,6-dichloro-nicotinamide Formula: C22H22Cl2N2O MolecularWeight: 401.32888

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)C5=CC(=C(N=C5)Cl)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)C5=CC(=C(N=C5)Cl)Cl

InChI

InChI=1S/C22H22Cl2N2O/c23-19-8-16(12-25-20(19)24)21(27)26-18-3-1-17(2-4-18)22-9-13-5-14(10-22)7-15(6-13)11-22/h1-4,8,12-15H,5-7,9-11H2,(H,26,27)