methyl 4-[4-aminocarbonyl-2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]benzoate

Systemtic Name: methyl 4-[4-aminocarbonyl-2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]benzoate Openeye Name: methyl 4-(1-benzyl-4-carbamoyl-2,5-dimethyl-pyrrol-3-yl)benzoate CAS Name: 4-[4-carbamoyl-2,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-(1-benzyl-4-carbamoyl-2,5-dimethylpyrrol-3-yl)benzoate Traditional Name: 4-(1-benzyl-4-carbamoyl-2,5-dimethyl-pyrrol-3-yl)benzoic acid methyl ester Formula: C22H22N2O3 MolecularWeight: 362.42168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2O3/c1-14-19(17-9-11-18(12-10-17)22(26)27-3)20(21(23)25)15(2)24(14)13-16-7-5-4-6-8-16/h4-12H,13H2,1-3H3,(H2,23,25)