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

Systemtic Name: methyl 4-[4-aminocarbonyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-2-pentyl-pyrrol-3-yl]benzoate Openeye Name: methyl 4-[4-carbamoyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-2-pentyl-pyrrol-3-yl]benzoate CAS Name: 4-[4-carbamoyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-2-pentyl-3-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-carbamoyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-2-pentylpyrrol-3-yl]benzoate Traditional Name: 4-(2-amyl-4-carbamoyl-1-homoveratryl-5-methyl-pyrrol-3-yl)benzoic acid methyl ester Formula: C29H36N2O5 MolecularWeight: 492.60654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(N1CCC2=CC(=C(C=C2)OC)OC)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCCC1=C(C(=C(N1CCC2=CC(=C(C=C2)OC)OC)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C29H36N2O5/c1-6-7-8-9-23-27(21-11-13-22(14-12-21)29(33)36-5)26(28(30)32)19(2)31(23)17-16-20-10-15-24(34-3)25(18-20)35-4/h10-15,18H,6-9,16-17H2,1-5H3,(H2,30,32)