(1R,3S)-5-(4-dimethylaminophenyl)adamantan-2-one

Systemtic Name: (1R,3S)-5-(4-dimethylaminophenyl)adamantan-2-one Openeye Name: (1R,3S)-5-(4-dimethylaminophenyl)adamantan-2-one CAS Name: (1R,3S)-5-(4-dimethylaminophenyl)-2-adamantanone IUPAC Name: (1R,3S)-5-(4-dimethylaminophenyl)adamantan-2-one Traditional Name: (1R,3S)-5-(4-dimethylaminophenyl)adamantan-2-one Formula: C18H23NO MolecularWeight: 269.38132

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C23CC4CC(C2)C(=O)C(C4)C3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C23C[C@H]4CC(C2)C[C@@H](C3)C4=O

InChI

InChI=1S/C18H23NO/c1-19(2)16-5-3-15(4-6-16)18-9-12-7-13(10-18)17(20)14(8-12)11-18/h3-6,12-14H,7-11H2,1-2H3/t12?,13-,14+,18?