(1R)-1-[(5S,7R)-3-(3,4-dimethylphenyl)-1-adamantyl]ethanamine

Systemtic Name: (1R)-1-[(5S,7R)-3-(3,4-dimethylphenyl)-1-adamantyl]ethanamine Openeye Name: (1R)-1-[(5S,7R)-3-(3,4-dimethylphenyl)-1-adamantyl]ethanamine CAS Name: (1R)-1-[(5S,7R)-3-(3,4-dimethylphenyl)-1-adamantyl]ethanamine IUPAC Name: (1R)-1-[(5S,7R)-3-(3,4-dimethylphenyl)-1-adamantyl]ethanamine Traditional Name: [(1R)-1-[(5S,7R)-3-(3,4-dimethylphenyl)-1-adamantyl]ethyl]amine Formula: C20H29N MolecularWeight: 283.45096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29N/c1-13-4-5-18(6-14(13)2)20-10-16-7-17(11-20)9-19(8-16,12-20)15(3)21/h4-6,15-17H,7-12,21H2,1-3H3/t15-,16-,17+,19?,20?/m1/s1