(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl (E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enoate

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl (E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enoate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl (E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enoate CAS Name: (E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-2-propenoic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl (E)-2-cyano-3-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)acrylic acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C25H24N2O4 MolecularWeight: 416.46906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C(=CC3=C(N(C(=C3)C)C4CC4)C)C#N

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)/C(=C/C3=C(N(C(=C3)C)C4CC4)C)/C#N

InChI

InChI=1S/C25H24N2O4/c1-4-17-5-8-22-20(12-24(28)31-23(22)10-17)14-30-25(29)19(13-26)11-18-9-15(2)27(16(18)3)21-6-7-21/h5,8-12,21H,4,6-7,14H2,1-3H3/b19-11+