5-[5-cyclopropyl-2,4-bis(oxidanyl)phenyl]-4-(1-ethylindol-4-yl)-1,2-dihydropyrazol-3-one

Systemtic Name: 5-[5-cyclopropyl-2,4-bis(oxidanyl)phenyl]-4-(1-ethylindol-4-yl)-1,2-dihydropyrazol-3-one Openeye Name: 5-(5-cyclopropyl-2,4-dihydroxy-phenyl)-4-(1-ethylindol-4-yl)-1,2-dihydropyrazol-3-one CAS Name: 5-(5-cyclopropyl-2,4-dihydroxyphenyl)-4-(1-ethyl-4-indolyl)-1,2-dihydropyrazol-3-one IUPAC Name: 5-(5-cyclopropyl-2,4-dihydroxyphenyl)-4-(1-ethylindol-4-yl)-1,2-dihydropyrazol-3-one Traditional Name: 5-(5-cyclopropyl-2,4-dihydroxy-phenyl)-4-(1-ethylindol-4-yl)-3-pyrazolin-3-one Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC2=C(C=CC=C21)C3=C(NNC3=O)C4=CC(=C(C=C4O)O)C5CC5

Isomeric SMILES

CCN1C=CC2=C(C=CC=C21)C3=C(NNC3=O)C4=CC(=C(C=C4O)O)C5CC5

InChI

InChI=1S/C22H21N3O3/c1-2-25-9-8-13-14(4-3-5-17(13)25)20-21(23-24-22(20)28)16-10-15(12-6-7-12)18(26)11-19(16)27/h3-5,8-12,26-27H,2,6-7H2,1H3,(H2,23,24,28)