5-[1-azanyl-4-(4-chlorophenyl)phthalazin-2-ium-2-yl]pentanoic acid

Systemtic Name: 5-[1-azanyl-4-(4-chlorophenyl)phthalazin-2-ium-2-yl]pentanoic acid Openeye Name: 5-[1-amino-4-(4-chlorophenyl)phthalazin-2-ium-2-yl]pentanoic acid CAS Name: 5-[1-amino-4-(4-chlorophenyl)-2-phthalazin-2-iumyl]pentanoic acid IUPAC Name: 5-[1-amino-4-(4-chlorophenyl)phthalazin-2-ium-2-yl]pentanoic acid Traditional Name: 5-[1-amino-4-(4-chlorophenyl)phthalazin-2-ium-2-yl]valeric acid Formula: C19H19ClN3O2+ MolecularWeight: 356.82606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=N[N+](=C2N)CCCCC(=O)O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=N[N+](=C2N)CCCCC(=O)O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H18ClN3O2/c20-14-10-8-13(9-11-14)18-15-5-1-2-6-16(15)19(21)23(22-18)12-4-3-7-17(24)25/h1-2,5-6,8-11,21H,3-4,7,12H2,(H,24,25)/p+1