methyl 3-[(E)-3-(2,4-dimethoxyphenyl)prop-2-enoyl]azulene-1-carboxylate

Systemtic Name: methyl 3-[(E)-3-(2,4-dimethoxyphenyl)prop-2-enoyl]azulene-1-carboxylate Openeye Name: methyl 3-[(E)-3-(2,4-dimethoxyphenyl)prop-2-enoyl]azulene-1-carboxylate CAS Name: 3-[(E)-3-(2,4-dimethoxyphenyl)-1-oxoprop-2-enyl]-1-azulenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(E)-3-(2,4-dimethoxyphenyl)prop-2-enoyl]azulene-1-carboxylate Traditional Name: 3-[(E)-3-(2,4-dimethoxyphenyl)acryloyl]azulene-1-carboxylic acid methyl ester Formula: C23H20O5 MolecularWeight: 376.4019

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C=CC(=O)C2=CC(=C3C2=CC=CC=C3)C(=O)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)/C=C/C(=O)C2=CC(=C3C2=CC=CC=C3)C(=O)OC)OC

InChI

InChI=1S/C23H20O5/c1-26-16-11-9-15(22(13-16)27-2)10-12-21(24)19-14-20(23(25)28-3)18-8-6-4-5-7-17(18)19/h4-14H,1-3H3/b12-10+