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

Systemtic Name: 3-cyanopropyl (E)-3-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]prop-2-enoate Openeye Name: 3-cyanopropyl (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 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl (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 3-cyanopropyl ester Formula: C17H19N3O3 MolecularWeight: 313.35106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O3/c1-12-10-15(6-7-17(21)22-9-5-4-8-18)14(3)20(12)16-11-13(2)23-19-16/h6-7,10-11H,4-5,9H2,1-3H3/b7-6+