butyl 1-(furan-2-ylmethyl)-5-[(2E)-2-hydroxyimino-2-phenyl-ethyl]pyrrole-3-carboxylate

Systemtic Name: butyl 1-(furan-2-ylmethyl)-5-[(2E)-2-hydroxyimino-2-phenyl-ethyl]pyrrole-3-carboxylate Openeye Name: butyl 1-(2-furylmethyl)-5-[(2E)-2-hydroxyimino-2-phenyl-ethyl]pyrrole-3-carboxylate CAS Name: 1-(2-furanylmethyl)-5-[(2E)-2-hydroxyimino-2-phenylethyl]-3-pyrrolecarboxylic acid butyl ester IUPAC Name: butyl 1-(furan-2-ylmethyl)-5-[(2E)-2-hydroxyimino-2-phenylethyl]pyrrole-3-carboxylate Traditional Name: 1-(2-furfuryl)-5-[(2E)-2-hydroximino-2-phenyl-ethyl]pyrrole-3-carboxylic acid butyl ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CN(C(=C1)CC(=NO)C2=CC=CC=C2)CC3=CC=CO3

Isomeric SMILES

CCCCOC(=O)C1=CN(C(=C1)C/C(=N\O)/C2=CC=CC=C2)CC3=CC=CO3

InChI

InChI=1S/C22H24N2O4/c1-2-3-11-28-22(25)18-13-19(24(15-18)16-20-10-7-12-27-20)14-21(23-26)17-8-5-4-6-9-17/h4-10,12-13,15,26H,2-3,11,14,16H2,1H3/b23-21+