[4-(3-methoxyphenyl)piperazin-1-yl]-[(5S,7R)-3-oxidanyl-1-adamantyl]methanone

Systemtic Name: [4-(3-methoxyphenyl)piperazin-1-yl]-[(5S,7R)-3-oxidanyl-1-adamantyl]methanone Openeye Name: [(5S,7R)-3-hydroxy-1-adamantyl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [(5S,7R)-3-hydroxy-1-adamantyl]-[4-(3-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [(5S,7R)-3-hydroxy-1-adamantyl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [(5S,7R)-3-hydroxy-1-adamantyl]-[4-(3-methoxyphenyl)piperazino]methanone Formula: C22H30N2O3 MolecularWeight: 370.4852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C34C[C@H]5C[C@@H](C3)CC(C5)(C4)O

InChI

InChI=1S/C22H30N2O3/c1-27-19-4-2-3-18(10-19)23-5-7-24(8-6-23)20(25)21-11-16-9-17(12-21)14-22(26,13-16)15-21/h2-4,10,16-17,26H,5-9,11-15H2,1H3/t16-,17+,21?,22?