1-chloranyl-4-[(1E,2R)-3-methyl-1-[(2R,5S)-5-methyl-2-propan-2-yl-cyclohexylidene]butan-2-yl]benzene

Systemtic Name: 1-chloranyl-4-[(1E,2R)-3-methyl-1-[(2R,5S)-5-methyl-2-propan-2-yl-cyclohexylidene]butan-2-yl]benzene Openeye Name: 1-chloro-4-[(1R)-1-[(E)-[(2R,5S)-2-isopropyl-5-methyl-cyclohexylidene]methyl]-2-methyl-propyl]benzene CAS Name: 1-chloro-4-[(1E,2R)-3-methyl-1-[(2R,5S)-5-methyl-2-propan-2-ylcyclohexylidene]butan-2-yl]benzene IUPAC Name: 1-chloro-4-[(1E,2R)-3-methyl-1-[(2R,5S)-5-methyl-2-propan-2-ylcyclohexylidene]butan-2-yl]benzene Traditional Name: 1-chloro-4-[(1R)-1-[(E)-[(2R,5S)-2-isopropyl-5-methyl-cyclohexylidene]methyl]-2-methyl-propyl]benzene Formula: C21H31Cl MolecularWeight: 318.92384

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(=CC(C2=CC=C(C=C2)Cl)C(C)C)C1)C(C)C

Isomeric SMILES

C[C@H]1CC[C@@H](/C(=C/[C@H](C2=CC=C(C=C2)Cl)C(C)C)/C1)C(C)C

InChI

InChI=1S/C21H31Cl/c1-14(2)20-11-6-16(5)12-18(20)13-21(15(3)4)17-7-9-19(22)10-8-17/h7-10,13-16,20-21H,6,11-12H2,1-5H3/b18-13+/t16-,20+,21-/m0/s1