2-[3-azanyl-5-(4-methoxyphenyl)-2-methyl-1H-pyrazol-2-ium-4-yl]-1H-quinazolin-4-one

Systemtic Name: 2-[3-azanyl-5-(4-methoxyphenyl)-2-methyl-1H-pyrazol-2-ium-4-yl]-1H-quinazolin-4-one Openeye Name: 2-[3-amino-5-(4-methoxyphenyl)-2-methyl-1H-pyrazol-2-ium-4-yl]-1H-quinazolin-4-one CAS Name: 2-[3-amino-5-(4-methoxyphenyl)-2-methyl-1H-pyrazol-2-ium-4-yl]-1H-quinazolin-4-one IUPAC Name: 2-[3-amino-5-(4-methoxyphenyl)-2-methyl-1H-pyrazol-2-ium-4-yl]-1H-quinazolin-4-one Traditional Name: 2-[3-amino-5-(4-methoxyphenyl)-2-methyl-1H-pyrazol-2-ium-4-yl]-1H-quinazolin-4-one Formula: C19H18N5O2+ MolecularWeight: 348.37852

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C(=C(N1)C2=CC=C(C=C2)OC)C3=NC(=O)C4=CC=CC=C4N3)N

Isomeric SMILES

C[N+]1=C(C(=C(N1)C2=CC=C(C=C2)OC)C3=NC(=O)C4=CC=CC=C4N3)N

InChI

InChI=1S/C19H17N5O2/c1-24-17(20)15(16(23-24)11-7-9-12(26-2)10-8-11)18-21-14-6-4-3-5-13(14)19(25)22-18/h3-10H,1-2H3,(H3,20,21,22,23,25)/p+1