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

Systemtic Name: methyl 3-[4-aminocarbonyl-3-(4-cyanophenyl)-5-methyl-1-(3-oxidanylpropyl)pyrrol-2-yl]propanoate Openeye Name: methyl 3-[4-carbamoyl-3-(4-cyanophenyl)-1-(3-hydroxypropyl)-5-methyl-pyrrol-2-yl]propanoate CAS Name: 3-[4-carbamoyl-3-(4-cyanophenyl)-1-(3-hydroxypropyl)-5-methyl-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-carbamoyl-3-(4-cyanophenyl)-1-(3-hydroxypropyl)-5-methylpyrrol-2-yl]propanoate Traditional Name: 3-[4-carbamoyl-3-(4-cyanophenyl)-1-(3-hydroxypropyl)-5-methyl-pyrrol-2-yl]propionic acid methyl ester Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O4/c1-13-18(20(22)26)19(15-6-4-14(12-21)5-7-15)16(8-9-17(25)27-2)23(13)10-3-11-24/h4-7,24H,3,8-11H2,1-2H3,(H2,22,26)