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

Systemtic Name: methyl 4-[4-aminocarbonyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-2-propyl-pyrrol-3-yl]benzoate Openeye Name: methyl 4-[4-carbamoyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-2-propyl-pyrrol-3-yl]benzoate CAS Name: 4-[4-carbamoyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-2-propyl-3-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-carbamoyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-2-propylpyrrol-3-yl]benzoate Traditional Name: 4-(4-carbamoyl-1-homoveratryl-5-methyl-2-propyl-pyrrol-3-yl)benzoic acid methyl ester Formula: C27H32N2O5 MolecularWeight: 464.55338

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(N1CCC2=CC(=C(C=C2)OC)OC)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCC1=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/C27H32N2O5/c1-6-7-21-25(19-9-11-20(12-10-19)27(31)34-5)24(26(28)30)17(2)29(21)15-14-18-8-13-22(32-3)23(16-18)33-4/h8-13,16H,6-7,14-15H2,1-5H3,(H2,28,30)