(6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl (E)-3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)prop-2-enoate

Systemtic Name: (6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl (E)-3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)prop-2-enoate Openeye Name: (6-chloro-7-ethyl-2-oxo-chromen-4-yl)methyl (E)-3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-(5-chloro-1,3-dimethyl-4-pyrazolyl)-2-propenoic acid (6-chloro-7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-ethyl-2-oxochromen-4-yl)methyl (E)-3-(5-chloro-1,3-dimethylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)acrylic acid (6-chloro-7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C20H18Cl2N2O4 MolecularWeight: 421.27392

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C=CC3=C(N(N=C3C)C)Cl)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)/C=C/C3=C(N(N=C3C)C)Cl)Cl

InChI

InChI=1S/C20H18Cl2N2O4/c1-4-12-7-17-15(9-16(12)21)13(8-19(26)28-17)10-27-18(25)6-5-14-11(2)23-24(3)20(14)22/h5-9H,4,10H2,1-3H3/b6-5+