methyl 3-[4-aminocarbonyl-5-methyl-1-(3-oxidanylpropyl)-3-pyridin-3-yl-pyrrol-2-yl]propanoate

Systemtic Name: methyl 3-[4-aminocarbonyl-5-methyl-1-(3-oxidanylpropyl)-3-pyridin-3-yl-pyrrol-2-yl]propanoate Openeye Name: methyl 3-[4-carbamoyl-1-(3-hydroxypropyl)-5-methyl-3-(3-pyridyl)pyrrol-2-yl]propanoate CAS Name: 3-[4-carbamoyl-1-(3-hydroxypropyl)-5-methyl-3-(3-pyridinyl)-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-carbamoyl-1-(3-hydroxypropyl)-5-methyl-3-pyridin-3-ylpyrrol-2-yl]propanoate Traditional Name: 3-[4-carbamoyl-1-(3-hydroxypropyl)-5-methyl-3-(3-pyridyl)pyrrol-2-yl]propionic acid methyl ester Formula: C18H23N3O4 MolecularWeight: 345.39292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CCCO)CCC(=O)OC)C2=CN=CC=C2)C(=O)N

Isomeric SMILES

CC1=C(C(=C(N1CCCO)CCC(=O)OC)C2=CN=CC=C2)C(=O)N

InChI

InChI=1S/C18H23N3O4/c1-12-16(18(19)24)17(13-5-3-8-20-11-13)14(6-7-15(23)25-2)21(12)9-4-10-22/h3,5,8,11,22H,4,6-7,9-10H2,1-2H3,(H2,19,24)