methyl 2-(4-methylthiophen-2-yl)-3-phenyl-azulene-1-carboxylate

Systemtic Name: methyl 2-(4-methylthiophen-2-yl)-3-phenyl-azulene-1-carboxylate Openeye Name: methyl 2-(4-methyl-2-thienyl)-3-phenyl-azulene-1-carboxylate CAS Name: 2-(4-methyl-2-thiophenyl)-3-phenyl-1-azulenecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-methylthiophen-2-yl)-3-phenylazulene-1-carboxylate Traditional Name: 2-(4-methyl-2-thienyl)-3-phenyl-azulene-1-carboxylic acid methyl ester Formula: C23H18O2S MolecularWeight: 358.45282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C2=C(C3=CC=CC=CC3=C2C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=CSC(=C1)C2=C(C3=CC=CC=CC3=C2C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C23H18O2S/c1-15-13-19(26-14-15)22-20(16-9-5-3-6-10-16)17-11-7-4-8-12-18(17)21(22)23(24)25-2/h3-14H,1-2H3