[5-(2-adamantylmethylcarbamoyl)-6-oxidanylidene-1H-pyridin-2-yl]methyl-(2-hydroxyethyl)-methyl-azanium

Systemtic Name: [5-(2-adamantylmethylcarbamoyl)-6-oxidanylidene-1H-pyridin-2-yl]methyl-(2-hydroxyethyl)-methyl-azanium Openeye Name: [5-(2-adamantylmethylcarbamoyl)-6-oxo-1H-pyridin-2-yl]methyl-(2-hydroxyethyl)-methyl-ammonium CAS Name: [5-[(2-adamantylmethylamino)-oxomethyl]-6-oxo-1H-pyridin-2-yl]methyl-(2-hydroxyethyl)-methylammonium IUPAC Name: [5-(2-adamantylmethylcarbamoyl)-6-oxo-1H-pyridin-2-yl]methyl-(2-hydroxyethyl)-methylazanium Traditional Name: [5-(2-adamantylmethylcarbamoyl)-6-keto-1H-pyridin-2-yl]methyl-(2-hydroxyethyl)-methyl-ammonium Formula: C21H32N3O3+ MolecularWeight: 374.49708

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCO)CC1=CC=C(C(=O)N1)C(=O)NCC2C3CC4CC(C3)CC2C4

Isomeric SMILES

C[NH+](CCO)CC1=CC=C(C(=O)N1)C(=O)NCC2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C21H31N3O3/c1-24(4-5-25)12-17-2-3-18(21(27)23-17)20(26)22-11-19-15-7-13-6-14(9-15)10-16(19)8-13/h2-3,13-16,19,25H,4-12H2,1H3,(H,22,26)(H,23,27)/p+1