2-(1-hydroxyethyl)-7-oxidanylidene-8-(4-phenylmethoxyphenyl)thieno[2,3-a]quinolizine-10-carboxylic acid

Systemtic Name: 2-(1-hydroxyethyl)-7-oxidanylidene-8-(4-phenylmethoxyphenyl)thieno[2,3-a]quinolizine-10-carboxylic acid Openeye Name: 8-(4-benzyloxyphenyl)-2-(1-hydroxyethyl)-7-oxo-thieno[2,3-a]quinolizine-10-carboxylic acid CAS Name: 2-(1-hydroxyethyl)-7-oxo-8-(4-phenylmethoxyphenyl)-10-thieno[2,3-a]quinolizinecarboxylic acid IUPAC Name: 2-(1-hydroxyethyl)-7-oxo-8-(4-phenylmethoxyphenyl)thieno[2,3-a]quinolizine-10-carboxylic acid Traditional Name: 8-(4-benzoxyphenyl)-2-(1-hydroxyethyl)-7-keto-thieno[2,3-a]quinolizine-10-carboxylic acid Formula: C27H21NO5S MolecularWeight: 471.52434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(S1)C3=C(C=C(C(=O)N3C=C2)C4=CC=C(C=C4)OCC5=CC=CC=C5)C(=O)O)O

Isomeric SMILES

CC(C1=CC2=C(S1)C3=C(C=C(C(=O)N3C=C2)C4=CC=C(C=C4)OCC5=CC=CC=C5)C(=O)O)O

InChI

InChI=1S/C27H21NO5S/c1-16(29)23-13-19-11-12-28-24(25(19)34-23)22(27(31)32)14-21(26(28)30)18-7-9-20(10-8-18)33-15-17-5-3-2-4-6-17/h2-14,16,29H,15H2,1H3,(H,31,32)