[1-[1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-1-oxidanylidene-propan-2-yl] (E)-but-2-enoate

Systemtic Name: [1-[1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-1-oxidanylidene-propan-2-yl] (E)-but-2-enoate Openeye Name: [2-[1-(2-furylmethyl)-2,5-dimethyl-pyrrol-3-yl]-1-methyl-2-oxo-ethyl] (E)-but-2-enoate CAS Name: (E)-2-butenoic acid [1-[1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolyl]-1-oxopropan-2-yl] ester IUPAC Name: [1-[1-(furan-2-ylmethyl)-2,5-dimethylpyrrol-3-yl]-1-oxopropan-2-yl] (E)-but-2-enoate Traditional Name: (E)-but-2-enoic acid [2-[1-(2-furfuryl)-2,5-dimethyl-pyrrol-3-yl]-2-keto-1-methyl-ethyl] ester Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)OC(C)C(=O)C1=C(N(C(=C1)C)CC2=CC=CO2)C

Isomeric SMILES

C/C=C/C(=O)OC(C)C(=O)C1=C(N(C(=C1)C)CC2=CC=CO2)C

InChI

InChI=1S/C18H21NO4/c1-5-7-17(20)23-14(4)18(21)16-10-12(2)19(13(16)3)11-15-8-6-9-22-15/h5-10,14H,11H2,1-4H3/b7-5+