[2,5-ditert-butyl-4-(3,8-dimethyl-5-propan-2-yl-azulen-1-yl)carbonyloxy-phenyl] 3,8-dimethyl-5-propan-2-yl-azulene-1-carboxylate

Systemtic Name: [2,5-ditert-butyl-4-(3,8-dimethyl-5-propan-2-yl-azulen-1-yl)carbonyloxy-phenyl] 3,8-dimethyl-5-propan-2-yl-azulene-1-carboxylate Openeye Name: [2,5-ditert-butyl-4-(5-isopropyl-3,8-dimethyl-azulene-1-carbonyl)oxy-phenyl] 5-isopropyl-3,8-dimethyl-azulene-1-carboxylate CAS Name: 3,8-dimethyl-5-propan-2-yl-1-azulenecarboxylic acid [2,5-ditert-butyl-4-[(3,8-dimethyl-5-propan-2-yl-1-azulenyl)-oxomethoxy]phenyl] ester IUPAC Name: [2,5-ditert-butyl-4-(3,8-dimethyl-5-propan-2-ylazulene-1-carbonyl)oxyphenyl] 3,8-dimethyl-5-propan-2-ylazulene-1-carboxylate Traditional Name: 5-isopropyl-3,8-dimethyl-azulene-1-carboxylic acid [2,5-ditert-butyl-4-(5-isopropyl-3,8-dimethyl-azulene-1-carbonyl)oxy-phenyl] ester Formula: C46H54O4 MolecularWeight: 670.91856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C2C=C(C=C1)C(C)C)C)C(=O)OC3=CC(=C(C=C3C(C)(C)C)OC(=O)C4=CC(=C5C4=C(C=CC(=C5)C(C)C)C)C)C(C)(C)C

Isomeric SMILES

CC1=C2C(=CC(=C2C=C(C=C1)C(C)C)C)C(=O)OC3=CC(=C(C=C3C(C)(C)C)OC(=O)C4=CC(=C5C4=C(C=CC(=C5)C(C)C)C)C)C(C)(C)C

InChI

InChI=1S/C46H54O4/c1-25(2)31-17-15-27(5)41-33(21-31)29(7)19-35(41)43(47)49-39-23-38(46(12,13)14)40(24-37(39)45(9,10)11)50-44(48)36-20-30(8)34-22-32(26(3)4)18-16-28(6)42(34)36/h15-26H,1-14H3