methyl 4-[(E)-2-(3,8-dimethyl-5-propan-2-yl-azulen-1-yl)ethenyl]benzoate

Systemtic Name: methyl 4-[(E)-2-(3,8-dimethyl-5-propan-2-yl-azulen-1-yl)ethenyl]benzoate Openeye Name: methyl 4-[(E)-2-(5-isopropyl-3,8-dimethyl-azulen-1-yl)vinyl]benzoate CAS Name: 4-[(E)-2-(3,8-dimethyl-5-propan-2-yl-1-azulenyl)ethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-2-(3,8-dimethyl-5-propan-2-ylazulen-1-yl)ethenyl]benzoate Traditional Name: 4-[(E)-2-(5-isopropyl-3,8-dimethyl-azulen-1-yl)vinyl]benzoic acid methyl ester Formula: C25H26O2 MolecularWeight: 358.47274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C2C=C(C=C1)C(C)C)C)C=CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C2C(=CC(=C2C=C(C=C1)C(C)C)C)/C=C/C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C25H26O2/c1-16(2)21-10-6-17(3)24-22(14-18(4)23(24)15-21)13-9-19-7-11-20(12-8-19)25(26)27-5/h6-16H,1-5H3/b13-9+