(E)-3-(3-ethoxy-2-propoxy-phenyl)-1-(2-methyl-4-prop-2-enyl-pyrazolo[1,5-a]benzimidazol-3-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(3-ethoxy-2-propoxy-phenyl)-1-(2-methyl-4-prop-2-enyl-pyrazolo[1,5-a]benzimidazol-3-yl)prop-2-en-1-one Openeye Name: (E)-1-(4-allyl-2-methyl-pyrazolo[1,5-a]benzimidazol-3-yl)-3-(3-ethoxy-2-propoxy-phenyl)prop-2-en-1-one CAS Name: (E)-3-(3-ethoxy-2-propoxyphenyl)-1-(2-methyl-4-prop-2-enyl-3-pyrazolo[1,5-a]benzimidazolyl)-2-propen-1-one IUPAC Name: (E)-3-(3-ethoxy-2-propoxyphenyl)-1-(2-methyl-4-prop-2-enylpyrazolo[1,5-a]benzimidazol-3-yl)prop-2-en-1-one Traditional Name: (E)-1-(4-allyl-2-methyl-pyrazolo[1,5-a]benzimidazol-3-yl)-3-(3-ethoxy-2-propoxy-phenyl)prop-2-en-1-one Formula: C27H29N3O3 MolecularWeight: 443.53746

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC=C1OCC)C=CC(=O)C2=C3N(C4=CC=CC=C4N3N=C2C)CC=C

Isomeric SMILES

CCCOC1=C(C=CC=C1OCC)/C=C/C(=O)C2=C3N(C4=CC=CC=C4N3N=C2C)CC=C

InChI

InChI=1S/C27H29N3O3/c1-5-17-29-21-12-8-9-13-22(21)30-27(29)25(19(4)28-30)23(31)16-15-20-11-10-14-24(32-7-3)26(20)33-18-6-2/h5,8-16H,1,6-7,17-18H2,2-4H3/b16-15+