N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-oxidanyl-adamantane-1-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-oxidanyl-adamantane-1-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-hydroxy-N-methyl-adamantane-1-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-hydroxy-N-methyl-1-adamantanecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-hydroxy-N-methyladamantane-1-carboxamide Traditional Name: N-homoveratryl-3-hydroxy-N-methyl-adamantane-1-carboxamide Formula: C22H31NO4 MolecularWeight: 373.48584

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)C23CC4CC(C2)CC(C4)(C3)O

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)C23CC4CC(C2)CC(C4)(C3)O

InChI

InChI=1S/C22H31NO4/c1-23(7-6-15-4-5-18(26-2)19(9-15)27-3)20(24)21-10-16-8-17(11-21)13-22(25,12-16)14-21/h4-5,9,16-17,25H,6-8,10-14H2,1-3H3