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

Systemtic Name: methyl 4-[4-aminocarbonyl-2-butyl-5-methyl-1-(3-morpholin-4-ylpropyl)pyrrol-3-yl]benzoate Openeye Name: methyl 4-[2-butyl-4-carbamoyl-5-methyl-1-(3-morpholinopropyl)pyrrol-3-yl]benzoate CAS Name: 4-[2-butyl-4-carbamoyl-5-methyl-1-[3-(4-morpholinyl)propyl]-3-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-butyl-4-carbamoyl-5-methyl-1-(3-morpholin-4-ylpropyl)pyrrol-3-yl]benzoate Traditional Name: 4-[2-butyl-4-carbamoyl-5-methyl-1-(3-morpholinopropyl)pyrrol-3-yl]benzoic acid methyl ester Formula: C25H35N3O4 MolecularWeight: 441.5631

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CCCN2CCOCC2)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCC1=C(C(=C(N1CCCN2CCOCC2)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C25H35N3O4/c1-4-5-7-21-23(19-8-10-20(11-9-19)25(30)31-3)22(24(26)29)18(2)28(21)13-6-12-27-14-16-32-17-15-27/h8-11H,4-7,12-17H2,1-3H3,(H2,26,29)