(4E)-2-(3,8-dimethyl-5-propan-2-yl-azulen-1-yl)-3-oxidanyl-4-(3,5,8-trimethyl-3aH-azulen-1-ylidene)cyclobut-2-en-1-one

Systemtic Name: (4E)-2-(3,8-dimethyl-5-propan-2-yl-azulen-1-yl)-3-oxidanyl-4-(3,5,8-trimethyl-3aH-azulen-1-ylidene)cyclobut-2-en-1-one Openeye Name: (4E)-3-hydroxy-2-(5-isopropyl-3,8-dimethyl-azulen-1-yl)-4-(3,5,8-trimethyl-3aH-azulen-1-ylidene)cyclobut-2-en-1-one CAS Name: (4E)-2-(3,8-dimethyl-5-propan-2-yl-1-azulenyl)-3-hydroxy-4-(3,5,8-trimethyl-3aH-azulen-1-ylidene)-1-cyclobut-2-enone IUPAC Name: (4E)-2-(3,8-dimethyl-5-propan-2-ylazulen-1-yl)-3-hydroxy-4-(3,5,8-trimethyl-3aH-azulen-1-ylidene)cyclobut-2-en-1-one Traditional Name: (4E)-3-hydroxy-2-(5-isopropyl-3,8-dimethyl-azulen-1-yl)-4-(3,5,8-trimethyl-3aH-azulen-1-ylidene)cyclobut-2-en-1-one Formula: C32H32O2 MolecularWeight: 448.59528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2C(=CC(=C3C(=C(C3=O)C4=CC(=C5C4=C(C=CC(=C5)C(C)C)C)C)O)C2=C(C=C1)C)C

Isomeric SMILES

CC1=CC2C(=C/C(=C\3/C(=C(C3=O)C4=CC(=C5C4=C(C=CC(=C5)C(C)C)C)C)O)/C2=C(C=C1)C)C

InChI

InChI=1S/C32H32O2/c1-16(2)22-11-10-19(5)28-24(15-22)21(7)14-26(28)30-31(33)29(32(30)34)25-13-20(6)23-12-17(3)8-9-18(4)27(23)25/h8-16,23,33H,1-7H3/b29-25+