(2E,4E,6E,8E,10E)-13-[(7aS)-2,2,4,6,6-pentamethyl-7,7a-dihydro-3aH-1,3-benzodioxol-5-yl]-2,7,11-trimethyl-trideca-2,4,6,8,10-pentaen-12-ynal

Systemtic Name: (2E,4E,6E,8E,10E)-13-[(7aS)-2,2,4,6,6-pentamethyl-7,7a-dihydro-3aH-1,3-benzodioxol-5-yl]-2,7,11-trimethyl-trideca-2,4,6,8,10-pentaen-12-ynal Openeye Name: (2E,4E,6E,8E,10E)-13-[(7aS)-2,2,4,6,6-pentamethyl-7,7a-dihydro-3aH-1,3-benzodioxol-5-yl]-2,7,11-trimethyl-trideca-2,4,6,8,10-pentaen-12-ynal CAS Name: (2E,4E,6E,8E,10E)-13-[(7aS)-2,2,4,6,6-pentamethyl-7,7a-dihydro-3aH-1,3-benzodioxol-5-yl]-2,7,11-trimethyltrideca-2,4,6,8,10-pentaen-12-ynal IUPAC Name: (2E,4E,6E,8E,10E)-13-[(7aS)-2,2,4,6,6-pentamethyl-7,7a-dihydro-3aH-1,3-benzodioxol-5-yl]-2,7,11-trimethyltrideca-2,4,6,8,10-pentaen-12-ynal Traditional Name: (2E,4E,6E,8E,10E)-13-[(7aS)-2,2,4,6,6-pentamethyl-7,7a-dihydro-3aH-1,3-benzodioxol-5-yl]-2,7,11-trimethyl-trideca-2,4,6,8,10-pentaen-12-ynal Formula: C28H36O3 MolecularWeight: 420.58364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC2C1OC(O2)(C)C)(C)C)C#CC(=CC=CC(=CC=CC=C(C)C=O)C)C

Isomeric SMILES

CC1=C(C(C[C@H]2C1OC(O2)(C)C)(C)C)C#C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=O)/C)/C

InChI

InChI=1S/C28H36O3/c1-20(12-9-10-13-22(3)19-29)14-11-15-21(2)16-17-24-23(4)26-25(18-27(24,5)6)30-28(7,8)31-26/h9-15,19,25-26H,18H2,1-8H3/b10-9+,14-11+,20-12+,21-15+,22-13+/t25-,26?/m0/s1