2-methylpropyl 10,10-bis(oxidanylidene)-[1]benzothiolo[3,2-b]quinoline-4-carboxylate

Systemtic Name: 2-methylpropyl 10,10-bis(oxidanylidene)-[1]benzothiolo[3,2-b]quinoline-4-carboxylate Openeye Name: isobutyl 10,10-dioxobenzothiopheno[3,2-b]quinoline-4-carboxylate CAS Name: 10,10-dioxo-[1]benzothiolo[3,2-b]quinoline-4-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 10,10-dioxo-[1]benzothiolo[3,2-b]quinoline-4-carboxylate Traditional Name: 10,10-diketobenzothiopheno[3,2-b]quinoline-4-carboxylic acid isobutyl ester Formula: C20H17NO4S MolecularWeight: 367.41828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=CC2=CC3=C(C4=CC=CC=C4S3(=O)=O)N=C21

Isomeric SMILES

CC(C)COC(=O)C1=CC=CC2=CC3=C(C4=CC=CC=C4S3(=O)=O)N=C21

InChI

InChI=1S/C20H17NO4S/c1-12(2)11-25-20(22)15-8-5-6-13-10-17-19(21-18(13)15)14-7-3-4-9-16(14)26(17,23)24/h3-10,12H,11H2,1-2H3