1-adamantylmethyl-[(2S)-2-oxidanyl-3-(thiophen-2-ylmethoxy)propyl]azanium

Systemtic Name: 1-adamantylmethyl-[(2S)-2-oxidanyl-3-(thiophen-2-ylmethoxy)propyl]azanium Openeye Name: 1-adamantylmethyl-[(2S)-2-hydroxy-3-(2-thienylmethoxy)propyl]ammonium CAS Name: 1-adamantylmethyl-[(2S)-2-hydroxy-3-(thiophen-2-ylmethoxy)propyl]ammonium IUPAC Name: 1-adamantylmethyl-[(2S)-2-hydroxy-3-(thiophen-2-ylmethoxy)propyl]azanium Traditional Name: 1-adamantylmethyl-[(2S)-2-hydroxy-3-(2-thenyloxy)propyl]ammonium Formula: C19H30NO2S+ MolecularWeight: 336.512

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C[NH2+]CC(COCC4=CC=CS4)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C[NH2+]C[C@@H](COCC4=CC=CS4)O

InChI

InChI=1S/C19H29NO2S/c21-17(11-22-12-18-2-1-3-23-18)10-20-13-19-7-14-4-15(8-19)6-16(5-14)9-19/h1-3,14-17,20-21H,4-13H2/p+1/t14?,15?,16?,17-,19?/m0/s1