methyl 3-[4-aminocarbonyl-5-methyl-1-(phenylmethyl)-3-quinolin-2-yl-pyrrol-2-yl]propanoate

Systemtic Name: methyl 3-[4-aminocarbonyl-5-methyl-1-(phenylmethyl)-3-quinolin-2-yl-pyrrol-2-yl]propanoate Openeye Name: methyl 3-[1-benzyl-4-carbamoyl-5-methyl-3-(2-quinolyl)pyrrol-2-yl]propanoate CAS Name: 3-[4-carbamoyl-5-methyl-1-(phenylmethyl)-3-(2-quinolinyl)-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-(1-benzyl-4-carbamoyl-5-methyl-3-quinolin-2-ylpyrrol-2-yl)propanoate Traditional Name: 3-[1-benzyl-4-carbamoyl-5-methyl-3-(2-quinolyl)pyrrol-2-yl]propionic acid methyl ester Formula: C26H25N3O3 MolecularWeight: 427.495

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CC=CC=C2)CCC(=O)OC)C3=NC4=CC=CC=C4C=C3)C(=O)N

Isomeric SMILES

CC1=C(C(=C(N1CC2=CC=CC=C2)CCC(=O)OC)C3=NC4=CC=CC=C4C=C3)C(=O)N

InChI

InChI=1S/C26H25N3O3/c1-17-24(26(27)31)25(21-13-12-19-10-6-7-11-20(19)28-21)22(14-15-23(30)32-2)29(17)16-18-8-4-3-5-9-18/h3-13H,14-16H2,1-2H3,(H2,27,31)