methyl 3-[4-aminocarbonyl-1-butyl-5-methyl-3-(3-phenoxyphenyl)pyrrol-2-yl]propanoate

Systemtic Name: methyl 3-[4-aminocarbonyl-1-butyl-5-methyl-3-(3-phenoxyphenyl)pyrrol-2-yl]propanoate Openeye Name: methyl 3-[1-butyl-4-carbamoyl-5-methyl-3-(3-phenoxyphenyl)pyrrol-2-yl]propanoate CAS Name: 3-[1-butyl-4-carbamoyl-5-methyl-3-(3-phenoxyphenyl)-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[1-butyl-4-carbamoyl-5-methyl-3-(3-phenoxyphenyl)pyrrol-2-yl]propanoate Traditional Name: 3-[1-butyl-4-carbamoyl-5-methyl-3-(3-phenoxyphenyl)pyrrol-2-yl]propionic acid methyl ester Formula: C26H30N2O4 MolecularWeight: 434.5274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=C1CCC(=O)OC)C2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)N)C

Isomeric SMILES

CCCCN1C(=C(C(=C1CCC(=O)OC)C2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)N)C

InChI

InChI=1S/C26H30N2O4/c1-4-5-16-28-18(2)24(26(27)30)25(22(28)14-15-23(29)31-3)19-10-9-13-21(17-19)32-20-11-7-6-8-12-20/h6-13,17H,4-5,14-16H2,1-3H3,(H2,27,30)