(5S,7R)-3-(4-methoxyphenyl)-N-propyl-adamantane-1-carboxamide

Systemtic Name: (5S,7R)-3-(4-methoxyphenyl)-N-propyl-adamantane-1-carboxamide Openeye Name: (5S,7R)-3-(4-methoxyphenyl)-N-propyl-adamantane-1-carboxamide CAS Name: (5S,7R)-3-(4-methoxyphenyl)-N-propyl-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-(4-methoxyphenyl)-N-propyladamantane-1-carboxamide Traditional Name: (5S,7R)-3-(4-methoxyphenyl)-N-propyl-adamantane-1-carboxamide Formula: C21H29NO2 MolecularWeight: 327.46046

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C12CC3CC(C1)CC(C3)(C2)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCNC(=O)C12C[C@@H]3C[C@H](C1)CC(C3)(C2)C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H29NO2/c1-3-8-22-19(23)21-12-15-9-16(13-21)11-20(10-15,14-21)17-4-6-18(24-2)7-5-17/h4-7,15-16H,3,8-14H2,1-2H3,(H,22,23)/t15-,16+,20?,21?