methyl 5,10-dimethyl-4-[(1E,3E)-4-phenylbuta-1,3-dienyl]-7-propan-2-yl-heptalene-1-carboxylate

Systemtic Name: methyl 5,10-dimethyl-4-[(1E,3E)-4-phenylbuta-1,3-dienyl]-7-propan-2-yl-heptalene-1-carboxylate Openeye Name: methyl 7-isopropyl-5,10-dimethyl-4-[(1E,3E)-4-phenylbuta-1,3-dienyl]heptalene-1-carboxylate CAS Name: 5,10-dimethyl-4-[(1E,3E)-4-phenylbuta-1,3-dienyl]-7-propan-2-yl-1-heptalenecarboxylic acid methyl ester IUPAC Name: methyl 5,10-dimethyl-4-[(1E,3E)-4-phenylbuta-1,3-dienyl]-7-propan-2-ylheptalene-1-carboxylate Traditional Name: 7-isopropyl-5,10-dimethyl-4-[(1E,3E)-4-phenylbuta-1,3-dienyl]heptalene-1-carboxylic acid methyl ester Formula: C29H30O2 MolecularWeight: 410.5473

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C2C1=C(C=CC(=C2C)C=CC=CC3=CC=CC=C3)C(=O)OC)C(C)C

Isomeric SMILES

CC1=CC=C(C=C2C1=C(C=CC(=C2C)/C=C/C=C/C3=CC=CC=C3)C(=O)OC)C(C)C

InChI

InChI=1S/C29H30O2/c1-20(2)25-16-15-21(3)28-26(29(30)31-5)18-17-24(22(4)27(28)19-25)14-10-9-13-23-11-7-6-8-12-23/h6-20H,1-5H3/b13-9+,14-10+