methyl 4-[4-aminocarbonyl-1-[(2-methoxyphenyl)methyl]-5-methyl-2-pentyl-pyrrol-3-yl]benzoate

Systemtic Name: methyl 4-[4-aminocarbonyl-1-[(2-methoxyphenyl)methyl]-5-methyl-2-pentyl-pyrrol-3-yl]benzoate Openeye Name: methyl 4-[4-carbamoyl-1-[(2-methoxyphenyl)methyl]-5-methyl-2-pentyl-pyrrol-3-yl]benzoate CAS Name: 4-[4-carbamoyl-1-[(2-methoxyphenyl)methyl]-5-methyl-2-pentyl-3-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-carbamoyl-1-[(2-methoxyphenyl)methyl]-5-methyl-2-pentylpyrrol-3-yl]benzoate Traditional Name: 4-(2-amyl-4-carbamoyl-5-methyl-1-o-anisyl-pyrrol-3-yl)benzoic acid methyl ester Formula: C27H32N2O4 MolecularWeight: 448.55398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(N1CC2=CC=CC=C2OC)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCCC1=C(C(=C(N1CC2=CC=CC=C2OC)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C27H32N2O4/c1-5-6-7-11-22-25(19-13-15-20(16-14-19)27(31)33-4)24(26(28)30)18(2)29(22)17-21-10-8-9-12-23(21)32-3/h8-10,12-16H,5-7,11,17H2,1-4H3,(H2,28,30)