6-azanyl-3-methyl-1-(4-methylphenyl)-4-pyridin-1-ium-4-yl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-3-methyl-1-(4-methylphenyl)-4-pyridin-1-ium-4-yl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-3-methyl-1-(p-tolyl)-4-pyridin-1-ium-4-yl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-3-methyl-1-(4-methylphenyl)-4-(4-pyridin-1-iumyl)-4H-pyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-3-methyl-1-(4-methylphenyl)-4-pyridin-1-ium-4-yl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-3-methyl-1-(p-tolyl)-4-pyridin-1-ium-4-yl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Formula: C20H18N5O+ MolecularWeight: 344.38982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C(C(=C(O3)N)C#N)C4=CC=[NH+]C=C4)C(=N2)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C(C(=C(O3)N)C#N)C4=CC=[NH+]C=C4)C(=N2)C

InChI

InChI=1S/C20H17N5O/c1-12-3-5-15(6-4-12)25-20-17(13(2)24-25)18(14-7-9-23-10-8-14)16(11-21)19(22)26-20/h3-10,18H,22H2,1-2H3/p+1