methyl 4-[4-aminocarbonyl-2-ethyl-5-methyl-1-(3-oxidanylpropyl)pyrrol-3-yl]benzoate

Systemtic Name: methyl 4-[4-aminocarbonyl-2-ethyl-5-methyl-1-(3-oxidanylpropyl)pyrrol-3-yl]benzoate Openeye Name: methyl 4-[4-carbamoyl-2-ethyl-1-(3-hydroxypropyl)-5-methyl-pyrrol-3-yl]benzoate CAS Name: 4-[4-carbamoyl-2-ethyl-1-(3-hydroxypropyl)-5-methyl-3-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-carbamoyl-2-ethyl-1-(3-hydroxypropyl)-5-methylpyrrol-3-yl]benzoate Traditional Name: 4-[4-carbamoyl-2-ethyl-1-(3-hydroxypropyl)-5-methyl-pyrrol-3-yl]benzoic acid methyl ester Formula: C19H24N2O4 MolecularWeight: 344.40486

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1CCCO)C)C(=O)N)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1CCCO)C)C(=O)N)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C19H24N2O4/c1-4-15-17(13-6-8-14(9-7-13)19(24)25-3)16(18(20)23)12(2)21(15)10-5-11-22/h6-9,22H,4-5,10-11H2,1-3H3,(H2,20,23)