N-ethyl-N-[(2S)-2-(3-hydroxyphenyl)-2-oxidanyl-ethyl]adamantane-1-carboxamide

Systemtic Name: N-ethyl-N-[(2S)-2-(3-hydroxyphenyl)-2-oxidanyl-ethyl]adamantane-1-carboxamide Openeye Name: N-ethyl-N-[(2S)-2-hydroxy-2-(3-hydroxyphenyl)ethyl]adamantane-1-carboxamide CAS Name: N-ethyl-N-[(2S)-2-hydroxy-2-(3-hydroxyphenyl)ethyl]-1-adamantanecarboxamide IUPAC Name: N-ethyl-N-[(2S)-2-hydroxy-2-(3-hydroxyphenyl)ethyl]adamantane-1-carboxamide Traditional Name: N-ethyl-N-[(2S)-2-hydroxy-2-(3-hydroxyphenyl)ethyl]adamantane-1-carboxamide Formula: C21H29NO3 MolecularWeight: 343.45986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCN(C[C@H](C1=CC(=CC=C1)O)O)C(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H29NO3/c1-2-22(13-19(24)17-4-3-5-18(23)9-17)20(25)21-10-14-6-15(11-21)8-16(7-14)12-21/h3-5,9,14-16,19,23-24H,2,6-8,10-13H2,1H3/t14?,15?,16?,19-,21?/m1/s1