2-adamantyl-[(3S,5S)-1-(2,3-dihydro-1H-inden-2-yl)-5-(methylcarbamoyl)pyrrolidin-3-yl]azanium

Systemtic Name: 2-adamantyl-[(3S,5S)-1-(2,3-dihydro-1H-inden-2-yl)-5-(methylcarbamoyl)pyrrolidin-3-yl]azanium Openeye Name: 2-adamantyl-[(3S,5S)-1-indan-2-yl-5-(methylcarbamoyl)pyrrolidin-3-yl]ammonium CAS Name: 2-adamantyl-[(3S,5S)-1-(2,3-dihydro-1H-inden-2-yl)-5-(methylcarbamoyl)-3-pyrrolidinyl]ammonium IUPAC Name: 2-adamantyl-[(3S,5S)-1-(2,3-dihydro-1H-inden-2-yl)-5-(methylcarbamoyl)pyrrolidin-3-yl]azanium Traditional Name: 2-adamantyl-[(3S,5S)-1-indan-2-yl-5-(methylcarbamoyl)pyrrolidin-3-yl]ammonium Formula: C25H36N3O+ MolecularWeight: 394.57284

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CC(CN1C2CC3=CC=CC=C3C2)[NH2+]C4C5CC6CC(C5)CC4C6

Isomeric SMILES

CNC(=O)[C@@H]1C[C@@H](CN1C2CC3=CC=CC=C3C2)[NH2+]C4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C25H35N3O/c1-26-25(29)23-13-21(14-28(23)22-11-17-4-2-3-5-18(17)12-22)27-24-19-7-15-6-16(9-19)10-20(24)8-15/h2-5,15-16,19-24,27H,6-14H2,1H3,(H,26,29)/p+1/t15?,16?,19?,20?,21-,23-,24?/m0/s1