N-(1-adamantyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-[(3-methoxyphenyl)methyl]ethanamide

Systemtic Name: N-(1-adamantyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-[(3-methoxyphenyl)methyl]ethanamide Openeye Name: N-(1-adamantyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide CAS Name: N-(1-adamantyl)-2-[4-(4-hydroxyphenyl)-1-piperazinyl]-N-[(3-methoxyphenyl)methyl]acetamide IUPAC Name: N-(1-adamantyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide Traditional Name: N-(1-adamantyl)-2-[4-(4-hydroxyphenyl)piperazino]-N-m-anisyl-acetamide Formula: C30H39N3O3 MolecularWeight: 489.64896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(C(=O)CN2CCN(CC2)C3=CC=C(C=C3)O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

COC1=CC=CC(=C1)CN(C(=O)CN2CCN(CC2)C3=CC=C(C=C3)O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C30H39N3O3/c1-36-28-4-2-3-22(16-28)20-33(30-17-23-13-24(18-30)15-25(14-23)19-30)29(35)21-31-9-11-32(12-10-31)26-5-7-27(34)8-6-26/h2-8,16,23-25,34H,9-15,17-21H2,1H3