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

Systemtic Name: methyl 4-[4-aminocarbonyl-1-[2-(4-hydroxyphenyl)ethyl]-5-methyl-2-propyl-pyrrol-3-yl]benzoate Openeye Name: methyl 4-[4-carbamoyl-1-[2-(4-hydroxyphenyl)ethyl]-5-methyl-2-propyl-pyrrol-3-yl]benzoate CAS Name: 4-[4-carbamoyl-1-[2-(4-hydroxyphenyl)ethyl]-5-methyl-2-propyl-3-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-carbamoyl-1-[2-(4-hydroxyphenyl)ethyl]-5-methyl-2-propylpyrrol-3-yl]benzoate Traditional Name: 4-[4-carbamoyl-1-[2-(4-hydroxyphenyl)ethyl]-5-methyl-2-propyl-pyrrol-3-yl]benzoic acid methyl ester Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28N2O4/c1-4-5-21-23(18-8-10-19(11-9-18)25(30)31-3)22(24(26)29)16(2)27(21)15-14-17-6-12-20(28)13-7-17/h6-13,28H,4-5,14-15H2,1-3H3,(H2,26,29)