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

Systemtic Name: methyl 3-[4-aminocarbonyl-1-[(3-chlorophenyl)methyl]-3-(4-cyanophenyl)-5-methyl-pyrrol-2-yl]propanoate Openeye Name: methyl 3-[4-carbamoyl-1-[(3-chlorophenyl)methyl]-3-(4-cyanophenyl)-5-methyl-pyrrol-2-yl]propanoate CAS Name: 3-[4-carbamoyl-1-[(3-chlorophenyl)methyl]-3-(4-cyanophenyl)-5-methyl-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-carbamoyl-1-[(3-chlorophenyl)methyl]-3-(4-cyanophenyl)-5-methylpyrrol-2-yl]propanoate Traditional Name: 3-[4-carbamoyl-1-(3-chlorobenzyl)-3-(4-cyanophenyl)-5-methyl-pyrrol-2-yl]propionic acid methyl ester Formula: C24H22ClN3O3 MolecularWeight: 435.90278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CC(=CC=C2)Cl)CCC(=O)OC)C3=CC=C(C=C3)C#N)C(=O)N

Isomeric SMILES

CC1=C(C(=C(N1CC2=CC(=CC=C2)Cl)CCC(=O)OC)C3=CC=C(C=C3)C#N)C(=O)N

InChI

InChI=1S/C24H22ClN3O3/c1-15-22(24(27)30)23(18-8-6-16(13-26)7-9-18)20(10-11-21(29)31-2)28(15)14-17-4-3-5-19(25)12-17/h3-9,12H,10-11,14H2,1-2H3,(H2,27,30)