methyl 3-[4-aminocarbonyl-5-methyl-3-(8-oxidanylquinolin-2-yl)-1-phenethyl-pyrrol-2-yl]propanoate

Systemtic Name: methyl 3-[4-aminocarbonyl-5-methyl-3-(8-oxidanylquinolin-2-yl)-1-phenethyl-pyrrol-2-yl]propanoate Openeye Name: methyl 3-[4-carbamoyl-3-(8-hydroxy-2-quinolyl)-5-methyl-1-phenethyl-pyrrol-2-yl]propanoate CAS Name: 3-[4-carbamoyl-3-(8-hydroxy-2-quinolinyl)-5-methyl-1-phenethyl-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-carbamoyl-3-(8-hydroxyquinolin-2-yl)-5-methyl-1-phenethylpyrrol-2-yl]propanoate Traditional Name: 3-[4-carbamoyl-3-(8-hydroxy-2-quinolyl)-5-methyl-1-phenethyl-pyrrol-2-yl]propionic acid methyl ester Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CCC2=CC=CC=C2)CCC(=O)OC)C3=NC4=C(C=CC=C4O)C=C3)C(=O)N

Isomeric SMILES

CC1=C(C(=C(N1CCC2=CC=CC=C2)CCC(=O)OC)C3=NC4=C(C=CC=C4O)C=C3)C(=O)N

InChI

InChI=1S/C27H27N3O4/c1-17-24(27(28)33)25(20-12-11-19-9-6-10-22(31)26(19)29-20)21(13-14-23(32)34-2)30(17)16-15-18-7-4-3-5-8-18/h3-12,31H,13-16H2,1-2H3,(H2,28,33)