4-[(5Z)-5-[2-tert-butyl-3-(2-methylpropyl)-1H-pyrazol-5-ylidene]pyrrol-2-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[(5Z)-5-[2-tert-butyl-3-(2-methylpropyl)-1H-pyrazol-5-ylidene]pyrrol-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[(5Z)-5-(2-tert-butyl-3-isobutyl-1H-pyrazol-5-ylidene)pyrrol-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[(5Z)-5-[2-tert-butyl-3-(2-methylpropyl)-1H-pyrazol-5-ylidene]-2-pyrrolylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[(5Z)-5-[2-tert-butyl-3-(2-methylpropyl)-1H-pyrazol-5-ylidene]pyrrol-2-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[(5Z)-5-(1-tert-butyl-5-isobutyl-3-pyrazolin-3-ylidene)-3-pyrrolin-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C21H27N3O MolecularWeight: 337.45858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=C2C=CC(=C3C=CC(=O)C=C3)N2)NN1C(C)(C)C

Isomeric SMILES

CC(C)CC1=C/C(=C/2\C=CC(=C3C=CC(=O)C=C3)N2)/NN1C(C)(C)C

InChI

InChI=1S/C21H27N3O/c1-14(2)12-16-13-20(23-24(16)21(3,4)5)19-11-10-18(22-19)15-6-8-17(25)9-7-15/h6-11,13-14,22-23H,12H2,1-5H3/b20-19-