[3,4-bis(butanoylamino)-2-methyl-quinolin-8-yl] butanoate

Systemtic Name: [3,4-bis(butanoylamino)-2-methyl-quinolin-8-yl] butanoate Openeye Name: [3,4-bis(butanoylamino)-2-methyl-8-quinolyl] butanoate CAS Name: butanoic acid [2-methyl-3,4-bis(1-oxobutylamino)-8-quinolinyl] ester IUPAC Name: [3,4-bis(butanoylamino)-2-methylquinolin-8-yl] butanoate Traditional Name: butyric acid (3,4-dibutyramido-2-methyl-8-quinolyl) ester Formula: C22H29N3O4 MolecularWeight: 399.48336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C2=C(C(=CC=C2)OC(=O)CCC)N=C1C)NC(=O)CCC

Isomeric SMILES

CCCC(=O)NC1=C(C2=C(C(=CC=C2)OC(=O)CCC)N=C1C)NC(=O)CCC

InChI

InChI=1S/C22H29N3O4/c1-5-9-17(26)24-20-14(4)23-21-15(22(20)25-18(27)10-6-2)12-8-13-16(21)29-19(28)11-7-3/h8,12-13H,5-7,9-11H2,1-4H3,(H,24,26)(H,23,25,27)