1-(7-tert-butyl-3,3-dimethyl-2H-1-benzothiophen-5-yl)-4-cyclopropyl-butan-1-one

Systemtic Name: 1-(7-tert-butyl-3,3-dimethyl-2H-1-benzothiophen-5-yl)-4-cyclopropyl-butan-1-one Openeye Name: 1-(7-tert-butyl-3,3-dimethyl-2H-benzothiophen-5-yl)-4-cyclopropyl-butan-1-one CAS Name: 1-(7-tert-butyl-3,3-dimethyl-2H-1-benzothiophen-5-yl)-4-cyclopropyl-1-butanone IUPAC Name: 1-(7-tert-butyl-3,3-dimethyl-2H-1-benzothiophen-5-yl)-4-cyclopropylbutan-1-one Traditional Name: 1-(7-tert-butyl-3,3-dimethyl-2H-benzothiophen-5-yl)-4-cyclopropyl-butan-1-one Formula: C21H30OS MolecularWeight: 330.5273

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CSC2=C1C=C(C=C2C(C)(C)C)C(=O)CCCC3CC3)C

Isomeric SMILES

CC1(CSC2=C1C=C(C=C2C(C)(C)C)C(=O)CCCC3CC3)C

InChI

InChI=1S/C21H30OS/c1-20(2,3)16-11-15(18(22)8-6-7-14-9-10-14)12-17-19(16)23-13-21(17,4)5/h11-12,14H,6-10,13H2,1-5H3