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1-adamantyl-[(2R)-1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium

1-adamantyl-[(2R)-1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name:1-adamantyl-[(2R)-1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium
Openeye Name:1-adamantyl-[(1R)-2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl]ammonium
CAS Name:1-adamantyl-[(2R)-1-(1H-indol-3-yl)-1-oxopropan-2-yl]ammonium
IUPAC Name:1-adamantyl-[(2R)-1-(1H-indol-3-yl)-1-oxopropan-2-yl]azanium
Traditional Name:1-adamantyl-[(1R)-2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl]ammonium
Formula: C21H27N2O+
MolecularWeight: 323.45188
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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)[NH2+]C34CC5CC(C3)CC(C5)C4


Isomeric SMILES

C[C@H](C(=O)C1=CNC2=CC=CC=C21)[NH2+]C34CC5CC(C3)CC(C5)C4


InChI

InChI=1S/C21H26N2O/c1-13(20(24)18-12-22-19-5-3-2-4-17(18)19)23-21-9-14-6-15(10-21)8-16(7-14)11-21/h2-5,12-16,22-23H,6-11H2,1H3/p+1/t13-,14?,15?,16?,21?/m1/s1


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