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

Systemtic Name: [(5S,7R)-3-(3,4-dimethylphenyl)-1-adamantyl]methylazanium Openeye Name: [(5S,7R)-3-(3,4-dimethylphenyl)-1-adamantyl]methylammonium CAS Name: [(5S,7R)-3-(3,4-dimethylphenyl)-1-adamantyl]methylammonium IUPAC Name: [(5S,7R)-3-(3,4-dimethylphenyl)-1-adamantyl]methylazanium Traditional Name: [(5S,7R)-3-(3,4-dimethylphenyl)-1-adamantyl]methylammonium Formula: C19H28N+ MolecularWeight: 270.43232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C[NH3+])C

Isomeric SMILES

CC1=C(C=C(C=C1)C23C[C@@H]4C[C@H](C2)CC(C4)(C3)C[NH3+])C

InChI

InChI=1S/C19H27N/c1-13-3-4-17(5-14(13)2)19-9-15-6-16(10-19)8-18(7-15,11-19)12-20/h3-5,15-16H,6-12,20H2,1-2H3/p+1/t15-,16+,18?,19?