2-(4-chloranylpyrazol-1-yl)-1-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)ethanone

Systemtic Name: 2-(4-chloranylpyrazol-1-yl)-1-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)ethanone Openeye Name: 1-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-(4-chloropyrazol-1-yl)ethanone CAS Name: 2-(4-chloro-1-pyrazolyl)-1-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)ethanone IUPAC Name: 2-(4-chloropyrazol-1-yl)-1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)ethanone Traditional Name: 1-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-(4-chloropyrazol-1-yl)ethanone Formula: C14H16ClN3O MolecularWeight: 277.74934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C(=O)CN2C=C(C=N2)Cl

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C(=O)CN2C=C(C=N2)Cl

InChI

InChI=1S/C14H16ClN3O/c1-4-5-18-10(2)6-13(11(18)3)14(19)9-17-8-12(15)7-16-17/h4,6-8H,1,5,9H2,2-3H3