methyl 4-[4-aminocarbonyl-2-butyl-1-[2-(4-hydroxyphenyl)ethyl]-5-methyl-pyrrol-3-yl]benzoate

Systemtic Name: methyl 4-[4-aminocarbonyl-2-butyl-1-[2-(4-hydroxyphenyl)ethyl]-5-methyl-pyrrol-3-yl]benzoate Openeye Name: methyl 4-[2-butyl-4-carbamoyl-1-[2-(4-hydroxyphenyl)ethyl]-5-methyl-pyrrol-3-yl]benzoate CAS Name: 4-[2-butyl-4-carbamoyl-1-[2-(4-hydroxyphenyl)ethyl]-5-methyl-3-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-butyl-4-carbamoyl-1-[2-(4-hydroxyphenyl)ethyl]-5-methylpyrrol-3-yl]benzoate Traditional Name: 4-[2-butyl-4-carbamoyl-1-[2-(4-hydroxyphenyl)ethyl]-5-methyl-pyrrol-3-yl]benzoic acid methyl ester Formula: C26H30N2O4 MolecularWeight: 434.5274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CCC2=CC=C(C=C2)O)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCC1=C(C(=C(N1CCC2=CC=C(C=C2)O)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C26H30N2O4/c1-4-5-6-22-24(19-9-11-20(12-10-19)26(31)32-3)23(25(27)30)17(2)28(22)16-15-18-7-13-21(29)14-8-18/h7-14,29H,4-6,15-16H2,1-3H3,(H2,27,30)