3-cyclohexyloxypropyl-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]azanium

Systemtic Name: 3-cyclohexyloxypropyl-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]azanium Openeye Name: 3-(cyclohexoxy)propyl-[(4S)-thiochroman-4-yl]ammonium CAS Name: 3-cyclohexyloxypropyl-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]ammonium IUPAC Name: 3-cyclohexyloxypropyl-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]azanium Traditional Name: 3-(cyclohexoxy)propyl-[(4S)-thiochroman-4-yl]ammonium Formula: C18H28NOS+ MolecularWeight: 306.48602

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OCCC[NH2+]C2CCSC3=CC=CC=C23

Isomeric SMILES

C1CCC(CC1)OCCC[NH2+][C@H]2CCSC3=CC=CC=C23

InChI

InChI=1S/C18H27NOS/c1-2-7-15(8-3-1)20-13-6-12-19-17-11-14-21-18-10-5-4-9-16(17)18/h4-5,9-10,15,17,19H,1-3,6-8,11-14H2/p+1/t17-/m0/s1