1-cyanoethyl (E)-3-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]prop-2-enoate

Systemtic Name: 1-cyanoethyl (E)-3-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]prop-2-enoate Openeye Name: 1-cyanoethyl (E)-3-[2,5-dimethyl-1-(5-methylisoxazol-3-yl)pyrrol-3-yl]prop-2-enoate CAS Name: (E)-3-[2,5-dimethyl-1-(5-methyl-3-isoxazolyl)-3-pyrrolyl]-2-propenoic acid 1-cyanoethyl ester IUPAC Name: 1-cyanoethyl (E)-3-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]prop-2-enoate Traditional Name: (E)-3-[2,5-dimethyl-1-(5-methylisoxazol-3-yl)pyrrol-3-yl]acrylic acid 1-cyanoethyl ester Formula: C16H17N3O3 MolecularWeight: 299.32448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=NOC(=C2)C)C)C=CC(=O)OC(C)C#N

Isomeric SMILES

CC1=CC(=C(N1C2=NOC(=C2)C)C)/C=C/C(=O)OC(C)C#N

InChI

InChI=1S/C16H17N3O3/c1-10-7-14(5-6-16(20)21-12(3)9-17)13(4)19(10)15-8-11(2)22-18-15/h5-8,12H,1-4H3/b6-5+