4-(1-adamantyl)-2-chloranyl-aniline hydrochloride

Systemtic Name: 4-(1-adamantyl)-2-chloranyl-aniline hydrochloride Openeye Name: 4-(1-adamantyl)-2-chloro-aniline hydrochloride CAS Name: 4-(1-adamantyl)-2-chloroaniline hydrochloride IUPAC Name: 4-(1-adamantyl)-2-chloroaniline hydrochloride Traditional Name: [4-(1-adamantyl)-2-chloro-phenyl]amine hydrochloride Formula: C16H21Cl2N MolecularWeight: 298.25064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC(=C(C=C4)N)Cl.Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC(=C(C=C4)N)Cl.Cl

InChI

InChI=1S/C16H20ClN.ClH/c17-14-6-13(1-2-15(14)18)16-7-10-3-11(8-16)5-12(4-10)9-16;/h1-2,6,10-12H,3-5,7-9,18H2;1H