[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate

Systemtic Name: [2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate Openeye Name: [2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl] (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-(1,3,5-trimethyl-4-pyrazolyl)-2-propenoic acid [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(1,3,5-trimethylpyrazol-4-yl)acrylic acid [2-keto-2-(2-methyl-1H-indol-3-yl)ethyl] ester Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)COC(=O)C=CC3=C(N(N=C3C)C)C

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)COC(=O)/C=C/C3=C(N(N=C3C)C)C

InChI

InChI=1S/C20H21N3O3/c1-12-15(14(3)23(4)22-12)9-10-19(25)26-11-18(24)20-13(2)21-17-8-6-5-7-16(17)20/h5-10,21H,11H2,1-4H3/b10-9+