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

Systemtic Name: methyl 3-[4-aminocarbonyl-3-(4-cyanophenyl)-1-cyclopropyl-5-methyl-pyrrol-2-yl]propanoate Openeye Name: methyl 3-[4-carbamoyl-3-(4-cyanophenyl)-1-cyclopropyl-5-methyl-pyrrol-2-yl]propanoate CAS Name: 3-[4-carbamoyl-3-(4-cyanophenyl)-1-cyclopropyl-5-methyl-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-carbamoyl-3-(4-cyanophenyl)-1-cyclopropyl-5-methylpyrrol-2-yl]propanoate Traditional Name: 3-[4-carbamoyl-3-(4-cyanophenyl)-1-cyclopropyl-5-methyl-pyrrol-2-yl]propionic acid methyl ester Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C2CC2)CCC(=O)OC)C3=CC=C(C=C3)C#N)C(=O)N

Isomeric SMILES

CC1=C(C(=C(N1C2CC2)CCC(=O)OC)C3=CC=C(C=C3)C#N)C(=O)N

InChI

InChI=1S/C20H21N3O3/c1-12-18(20(22)25)19(14-5-3-13(11-21)4-6-14)16(9-10-17(24)26-2)23(12)15-7-8-15/h3-6,15H,7-10H2,1-2H3,(H2,22,25)