methyl 3-[4-aminocarbonyl-3-(4-tert-butylphenyl)-5-methyl-1-(3-morpholin-4-ylpropyl)pyrrol-2-yl]propanoate

Systemtic Name: methyl 3-[4-aminocarbonyl-3-(4-tert-butylphenyl)-5-methyl-1-(3-morpholin-4-ylpropyl)pyrrol-2-yl]propanoate Openeye Name: methyl 3-[3-(4-tert-butylphenyl)-4-carbamoyl-5-methyl-1-(3-morpholinopropyl)pyrrol-2-yl]propanoate CAS Name: 3-[3-(4-tert-butylphenyl)-4-carbamoyl-5-methyl-1-[3-(4-morpholinyl)propyl]-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-(4-tert-butylphenyl)-4-carbamoyl-5-methyl-1-(3-morpholin-4-ylpropyl)pyrrol-2-yl]propanoate Traditional Name: 3-[3-(4-tert-butylphenyl)-4-carbamoyl-5-methyl-1-(3-morpholinopropyl)pyrrol-2-yl]propionic acid methyl ester Formula: C27H39N3O4 MolecularWeight: 469.61626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CCCN2CCOCC2)CCC(=O)OC)C3=CC=C(C=C3)C(C)(C)C)C(=O)N

Isomeric SMILES

CC1=C(C(=C(N1CCCN2CCOCC2)CCC(=O)OC)C3=CC=C(C=C3)C(C)(C)C)C(=O)N

InChI

InChI=1S/C27H39N3O4/c1-19-24(26(28)32)25(20-7-9-21(10-8-20)27(2,3)4)22(11-12-23(31)33-5)30(19)14-6-13-29-15-17-34-18-16-29/h7-10H,6,11-18H2,1-5H3,(H2,28,32)