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

Systemtic Name: butyl (E)-2-cyano-3-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]prop-2-enoate Openeye Name: butyl (E)-2-cyano-3-[2,5-dimethyl-1-(5-methylisoxazol-3-yl)pyrrol-3-yl]prop-2-enoate CAS Name: (E)-2-cyano-3-[2,5-dimethyl-1-(5-methyl-3-isoxazolyl)-3-pyrrolyl]-2-propenoic acid butyl ester IUPAC Name: butyl (E)-2-cyano-3-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[2,5-dimethyl-1-(5-methylisoxazol-3-yl)pyrrol-3-yl]acrylic acid butyl ester Formula: C18H21N3O3 MolecularWeight: 327.37764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(=CC1=C(N(C(=C1)C)C2=NOC(=C2)C)C)C#N

Isomeric SMILES

CCCCOC(=O)/C(=C/C1=C(N(C(=C1)C)C2=NOC(=C2)C)C)/C#N

InChI

InChI=1S/C18H21N3O3/c1-5-6-7-23-18(22)16(11-19)10-15-8-12(2)21(14(15)4)17-9-13(3)24-20-17/h8-10H,5-7H2,1-4H3/b16-10+