triethyl-[(Z)-4-(1H-isothiochromen-1-yl)-2,3-dimethyl-but-2-enyl]azanium

Systemtic Name: triethyl-[(Z)-4-(1H-isothiochromen-1-yl)-2,3-dimethyl-but-2-enyl]azanium Openeye Name: triethyl-[(Z)-4-(1H-isothiochromen-1-yl)-2,3-dimethyl-but-2-enyl]ammonium CAS Name: [(Z)-4-(1H-2-benzothiopyran-1-yl)-2,3-dimethylbut-2-enyl]-triethylammonium IUPAC Name: triethyl-[(Z)-4-(1H-isothiochromen-1-yl)-2,3-dimethylbut-2-enyl]azanium Traditional Name: triethyl-[(Z)-4-(1H-isothiochromen-1-yl)-2,3-dimethyl-but-2-enyl]ammonium Formula: C21H32NS+ MolecularWeight: 330.55048

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CC(=C(C)CC1C2=CC=CC=C2C=CS1)C

Isomeric SMILES

CC[N+](CC)(CC)C/C(=C(/C)\CC1C2=CC=CC=C2C=CS1)/C

InChI

InChI=1S/C21H32NS/c1-6-22(7-2,8-3)16-18(5)17(4)15-21-20-12-10-9-11-19(20)13-14-23-21/h9-14,21H,6-8,15-16H2,1-5H3/q+1/b18-17-