methyl 3-[4-aminocarbonyl-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1-propan-2-yl-pyrrol-2-yl]propanoate

Systemtic Name: methyl 3-[4-aminocarbonyl-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1-propan-2-yl-pyrrol-2-yl]propanoate Openeye Name: methyl 3-[4-carbamoyl-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-isopropyl-5-methyl-pyrrol-2-yl]propanoate CAS Name: 3-[4-carbamoyl-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1-propan-2-yl-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-carbamoyl-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1-propan-2-ylpyrrol-2-yl]propanoate Traditional Name: 3-[4-carbamoyl-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-isopropyl-5-methyl-pyrrol-2-yl]propionic acid methyl ester Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C(C)C)CCC(=O)OC)C2=CC3=C(C=C2)OCCO3)C(=O)N

Isomeric SMILES

CC1=C(C(=C(N1C(C)C)CCC(=O)OC)C2=CC3=C(C=C2)OCCO3)C(=O)N

InChI

InChI=1S/C21H26N2O5/c1-12(2)23-13(3)19(21(22)25)20(15(23)6-8-18(24)26-4)14-5-7-16-17(11-14)28-10-9-27-16/h5,7,11-12H,6,8-10H2,1-4H3,(H2,22,25)