methyl 3-[4-aminocarbonyl-3-(4-methoxyphenyl)-5-methyl-1-phenethyl-pyrrol-2-yl]propanoate

Systemtic Name: methyl 3-[4-aminocarbonyl-3-(4-methoxyphenyl)-5-methyl-1-phenethyl-pyrrol-2-yl]propanoate Openeye Name: methyl 3-[4-carbamoyl-3-(4-methoxyphenyl)-5-methyl-1-phenethyl-pyrrol-2-yl]propanoate CAS Name: 3-[4-carbamoyl-3-(4-methoxyphenyl)-5-methyl-1-phenethyl-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-carbamoyl-3-(4-methoxyphenyl)-5-methyl-1-phenethylpyrrol-2-yl]propanoate Traditional Name: 3-[4-carbamoyl-3-(4-methoxyphenyl)-5-methyl-1-phenethyl-pyrrol-2-yl]propionic acid methyl ester Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CCC2=CC=CC=C2)CCC(=O)OC)C3=CC=C(C=C3)OC)C(=O)N

Isomeric SMILES

CC1=C(C(=C(N1CCC2=CC=CC=C2)CCC(=O)OC)C3=CC=C(C=C3)OC)C(=O)N

InChI

InChI=1S/C25H28N2O4/c1-17-23(25(26)29)24(19-9-11-20(30-2)12-10-19)21(13-14-22(28)31-3)27(17)16-15-18-7-5-4-6-8-18/h4-12H,13-16H2,1-3H3,(H2,26,29)