(E)-4-[3-(4-methoxyphenyl)-4,6,8-trimethyl-azulen-1-yl]oxy-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[3-(4-methoxyphenyl)-4,6,8-trimethyl-azulen-1-yl]oxy-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[3-(4-methoxyphenyl)-4,6,8-trimethyl-azulen-1-yl]oxy-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[3-(4-methoxyphenyl)-4,6,8-trimethyl-1-azulenyl]oxy]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[3-(4-methoxyphenyl)-4,6,8-trimethylazulen-1-yl]oxy-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-[3-(4-methoxyphenyl)-4,6,8-trimethyl-azulen-1-yl]oxy-but-2-enoic acid Formula: C24H22O5 MolecularWeight: 390.42848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H22O5/c1-14-11-15(2)23-19(17-5-7-18(28-4)8-6-17)13-20(24(23)16(3)12-14)29-22(27)10-9-21(25)26/h5-13H,1-4H3,(H,25,26)/b10-9+