6-azanyl-4-[3,4-bis(oxidanyl)phenyl]-1-phenyl-3-propyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-4-[3,4-bis(oxidanyl)phenyl]-1-phenyl-3-propyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-4-(3,4-dihydroxyphenyl)-1-phenyl-3-propyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-4-(3,4-dihydroxyphenyl)-1-phenyl-3-propyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-4-(3,4-dihydroxyphenyl)-1-phenyl-3-propyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-4-(3,4-dihydroxyphenyl)-1-phenyl-3-propyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)O)O)C4=CC=CC=C4

Isomeric SMILES

CCCC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)O)O)C4=CC=CC=C4

InChI

InChI=1S/C22H20N4O3/c1-2-6-16-20-19(13-9-10-17(27)18(28)11-13)15(12-23)21(24)29-22(20)26(25-16)14-7-4-3-5-8-14/h3-5,7-11,19,27-28H,2,6,24H2,1H3