4-(1-adamantylcarbonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]piperazine-1-carboxamide

Systemtic Name: 4-(1-adamantylcarbonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]piperazine-1-carboxamide Openeye Name: 4-(adamantane-1-carbonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]piperazine-1-carboxamide CAS Name: 4-[1-adamantyl(oxo)methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-piperazinecarboxamide IUPAC Name: 4-(adamantane-1-carbonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]piperazine-1-carboxamide Traditional Name: 4-(adamantane-1-carbonyl)-N-homoveratryl-piperazine-1-carboxamide Formula: C26H37N3O4 MolecularWeight: 455.58968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)N2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)N2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)C4)OC

InChI

InChI=1S/C26H37N3O4/c1-32-22-4-3-18(14-23(22)33-2)5-6-27-25(31)29-9-7-28(8-10-29)24(30)26-15-19-11-20(16-26)13-21(12-19)17-26/h3-4,14,19-21H,5-13,15-17H2,1-2H3,(H,27,31)