4-[2-(1,3-dimethyl-5-nitro-pyrazol-4-yl)-3,4-bis(4-hydroxyphenyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[2-(1,3-dimethyl-5-nitro-pyrazol-4-yl)-3,4-bis(4-hydroxyphenyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[2-(1,3-dimethyl-5-nitro-pyrazol-4-yl)-3,4-bis(4-hydroxyphenyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[2-(1,3-dimethyl-5-nitro-4-pyrazolyl)-3,4-bis(4-hydroxyphenyl)-1H-pyrazol-5-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[2-(1,3-dimethyl-5-nitropyrazol-4-yl)-3,4-bis(4-hydroxyphenyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[1-(1,3-dimethyl-5-nitro-pyrazol-4-yl)-4,5-bis(4-hydroxyphenyl)-3-pyrazolin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C26H21N5O5 MolecularWeight: 483.47544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1N2C(=C(C(=C3C=CC(=O)C=C3)N2)C4=CC=C(C=C4)O)C5=CC=C(C=C5)O)[N+](=O)[O-])C

Isomeric SMILES

CC1=NN(C(=C1N2C(=C(C(=C3C=CC(=O)C=C3)N2)C4=CC=C(C=C4)O)C5=CC=C(C=C5)O)[N+](=O)[O-])C

InChI

InChI=1S/C26H21N5O5/c1-15-24(26(31(35)36)29(2)27-15)30-25(18-7-13-21(34)14-8-18)22(16-3-9-19(32)10-4-16)23(28-30)17-5-11-20(33)12-6-17/h3-14,28,32,34H,1-2H3