N-(2-adamantyl)-2-[(2R)-1-(naphthalen-1-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-(2-adamantyl)-2-[(2R)-1-(naphthalen-1-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide Openeye Name: N-(2-adamantyl)-2-[(2R)-1-(1-naphthylmethyl)-3-oxo-piperazin-1-ium-2-yl]acetamide CAS Name: N-(2-adamantyl)-2-[(2R)-1-(1-naphthalenylmethyl)-3-oxo-2-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-adamantyl)-2-[(2R)-1-(naphthalen-1-ylmethyl)-3-oxopiperazin-1-ium-2-yl]acetamide Traditional Name: N-(2-adamantyl)-2-[(2R)-3-keto-1-(1-naphthylmethyl)piperazin-1-ium-2-yl]acetamide Formula: C27H34N3O2+ MolecularWeight: 432.57776

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C(C(=O)N1)CC(=O)NC2C3CC4CC(C3)CC2C4)CC5=CC=CC6=CC=CC=C65

Isomeric SMILES

C1C[NH+]([C@@H](C(=O)N1)CC(=O)NC2C3CC4CC(C3)CC2C4)CC5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C27H33N3O2/c31-25(29-26-21-11-17-10-18(13-21)14-22(26)12-17)15-24-27(32)28-8-9-30(24)16-20-6-3-5-19-4-1-2-7-23(19)20/h1-7,17-18,21-22,24,26H,8-16H2,(H,28,32)(H,29,31)/p+1/t17?,18?,21?,22?,24-,26?/m1/s1