5-[(5S,7R)-3-chloranyl-1-adamantyl]-2-methyl-aniline

Systemtic Name: 5-[(5S,7R)-3-chloranyl-1-adamantyl]-2-methyl-aniline Openeye Name: 5-[(5S,7R)-3-chloro-1-adamantyl]-2-methyl-aniline CAS Name: 5-[(5S,7R)-3-chloro-1-adamantyl]-2-methylaniline IUPAC Name: 5-[(5S,7R)-3-chloro-1-adamantyl]-2-methylaniline Traditional Name: [5-[(5S,7R)-3-chloro-1-adamantyl]-2-methyl-phenyl]amine Formula: C17H22ClN MolecularWeight: 275.81628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=C(C=C1)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)Cl)N

InChI

InChI=1S/C17H22ClN/c1-11-2-3-14(5-15(11)19)16-6-12-4-13(7-16)9-17(18,8-12)10-16/h2-3,5,12-13H,4,6-10,19H2,1H3/t12-,13+,16?,17?