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

Systemtic Name: methyl 3-[4-aminocarbonyl-5-methyl-1-(3-oxidanylpropyl)-3-quinolin-2-yl-pyrrol-2-yl]propanoate Openeye Name: methyl 3-[4-carbamoyl-1-(3-hydroxypropyl)-5-methyl-3-(2-quinolyl)pyrrol-2-yl]propanoate CAS Name: 3-[4-carbamoyl-1-(3-hydroxypropyl)-5-methyl-3-(2-quinolinyl)-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-carbamoyl-1-(3-hydroxypropyl)-5-methyl-3-quinolin-2-ylpyrrol-2-yl]propanoate Traditional Name: 3-[4-carbamoyl-1-(3-hydroxypropyl)-5-methyl-3-(2-quinolyl)pyrrol-2-yl]propionic acid methyl ester Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CCCO)CCC(=O)OC)C2=NC3=CC=CC=C3C=C2)C(=O)N

Isomeric SMILES

CC1=C(C(=C(N1CCCO)CCC(=O)OC)C2=NC3=CC=CC=C3C=C2)C(=O)N

InChI

InChI=1S/C22H25N3O4/c1-14-20(22(23)28)21(17-9-8-15-6-3-4-7-16(15)24-17)18(10-11-19(27)29-2)25(14)12-5-13-26/h3-4,6-9,26H,5,10-13H2,1-2H3,(H2,23,28)