4-[1-azanyl-4-(4-methoxyphenyl)phthalazin-2-ium-2-yl]butanoic acid

Systemtic Name: 4-[1-azanyl-4-(4-methoxyphenyl)phthalazin-2-ium-2-yl]butanoic acid Openeye Name: 4-[1-amino-4-(4-methoxyphenyl)phthalazin-2-ium-2-yl]butanoic acid CAS Name: 4-[1-amino-4-(4-methoxyphenyl)-2-phthalazin-2-iumyl]butanoic acid IUPAC Name: 4-[1-amino-4-(4-methoxyphenyl)phthalazin-2-ium-2-yl]butanoic acid Traditional Name: 4-[1-amino-4-(4-methoxyphenyl)phthalazin-2-ium-2-yl]butyric acid Formula: C19H20N3O3+ MolecularWeight: 338.3804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=N[N+](=C(C3=CC=CC=C32)N)CCCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=N[N+](=C(C3=CC=CC=C32)N)CCCC(=O)O

InChI

InChI=1S/C19H19N3O3/c1-25-14-10-8-13(9-11-14)18-15-5-2-3-6-16(15)19(20)22(21-18)12-4-7-17(23)24/h2-3,5-6,8-11,20H,4,7,12H2,1H3,(H,23,24)/p+1