methyl 3-(4-aminocarbonyl-1-butyl-5-methyl-3-quinolin-2-yl-pyrrol-2-yl)propanoate

Systemtic Name: methyl 3-(4-aminocarbonyl-1-butyl-5-methyl-3-quinolin-2-yl-pyrrol-2-yl)propanoate Openeye Name: methyl 3-[1-butyl-4-carbamoyl-5-methyl-3-(2-quinolyl)pyrrol-2-yl]propanoate CAS Name: 3-[1-butyl-4-carbamoyl-5-methyl-3-(2-quinolinyl)-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-(1-butyl-4-carbamoyl-5-methyl-3-quinolin-2-ylpyrrol-2-yl)propanoate Traditional Name: 3-[1-butyl-4-carbamoyl-5-methyl-3-(2-quinolyl)pyrrol-2-yl]propionic acid methyl ester Formula: C23H27N3O3 MolecularWeight: 393.47878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=C1CCC(=O)OC)C2=NC3=CC=CC=C3C=C2)C(=O)N)C

Isomeric SMILES

CCCCN1C(=C(C(=C1CCC(=O)OC)C2=NC3=CC=CC=C3C=C2)C(=O)N)C

InChI

InChI=1S/C23H27N3O3/c1-4-5-14-26-15(2)21(23(24)28)22(19(26)12-13-20(27)29-3)18-11-10-16-8-6-7-9-17(16)25-18/h6-11H,4-5,12-14H2,1-3H3,(H2,24,28)