(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-(1,3,5-trimethyl-4-pyrazolyl)-2-propenoic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(1,3,5-trimethylpyrazol-4-yl)acrylic acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C=CC3=C(N(N=C3C)C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)/C=C/C3=C(N(N=C3C)C)C

InChI

InChI=1S/C21H22N2O4/c1-5-15-6-7-18-16(11-21(25)27-19(18)10-15)12-26-20(24)9-8-17-13(2)22-23(4)14(17)3/h6-11H,5,12H2,1-4H3/b9-8+