1-ethyl-4-[3-[2-(4-hydroxyphenyl)-4-methyl-5H-1,2-oxazol-5-yl]propanoylamino]pyrrole-3-carboxylic acid

Systemtic Name: 1-ethyl-4-[3-[2-(4-hydroxyphenyl)-4-methyl-5H-1,2-oxazol-5-yl]propanoylamino]pyrrole-3-carboxylic acid Openeye Name: 1-ethyl-4-[3-[2-(4-hydroxyphenyl)-4-methyl-5H-isoxazol-5-yl]propanoylamino]pyrrole-3-carboxylic acid CAS Name: 1-ethyl-4-[[3-[2-(4-hydroxyphenyl)-4-methyl-5H-isoxazol-5-yl]-1-oxopropyl]amino]-3-pyrrolecarboxylic acid IUPAC Name: 1-ethyl-4-[3-[2-(4-hydroxyphenyl)-4-methyl-5H-1,2-oxazol-5-yl]propanoylamino]pyrrole-3-carboxylic acid Traditional Name: 1-ethyl-4-[3-[2-(4-hydroxyphenyl)-4-methyl-3-isoxazolin-5-yl]propanoylamino]pyrrole-3-carboxylic acid Formula: C20H23N3O5 MolecularWeight: 385.41372

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=C1)NC(=O)CCC2C(=CN(O2)C3=CC=C(C=C3)O)C)C(=O)O

Isomeric SMILES

CCN1C=C(C(=C1)NC(=O)CCC2C(=CN(O2)C3=CC=C(C=C3)O)C)C(=O)O

InChI

InChI=1S/C20H23N3O5/c1-3-22-11-16(20(26)27)17(12-22)21-19(25)9-8-18-13(2)10-23(28-18)14-4-6-15(24)7-5-14/h4-7,10-12,18,24H,3,8-9H2,1-2H3,(H,21,25)(H,26,27)