4-(1-adamantyloxy)-3-chloranyl-aniline hydrochloride

Systemtic Name: 4-(1-adamantyloxy)-3-chloranyl-aniline hydrochloride Openeye Name: 4-(1-adamantyloxy)-3-chloro-aniline hydrochloride CAS Name: 4-(1-adamantyloxy)-3-chloroaniline hydrochloride IUPAC Name: 4-(1-adamantyloxy)-3-chloroaniline hydrochloride Traditional Name: [4-(1-adamantyloxy)-3-chloro-phenyl]amine hydrochloride Formula: C16H21Cl2NO MolecularWeight: 314.25004

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)OC4=C(C=C(C=C4)N)Cl.Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)OC4=C(C=C(C=C4)N)Cl.Cl

InChI

InChI=1S/C16H20ClNO.ClH/c17-14-6-13(18)1-2-15(14)19-16-7-10-3-11(8-16)5-12(4-10)9-16;/h1-2,6,10-12H,3-5,7-9,18H2;1H