2-[4-[(1,4-dimethylindol-3-yl)methyl]-1-oxidanylidene-phthalazin-2-yl]pentanoic acid

Systemtic Name: 2-[4-[(1,4-dimethylindol-3-yl)methyl]-1-oxidanylidene-phthalazin-2-yl]pentanoic acid Openeye Name: 2-[4-[(1,4-dimethylindol-3-yl)methyl]-1-oxo-phthalazin-2-yl]pentanoic acid CAS Name: 2-[4-[(1,4-dimethyl-3-indolyl)methyl]-1-oxo-2-phthalazinyl]pentanoic acid IUPAC Name: 2-[4-[(1,4-dimethylindol-3-yl)methyl]-1-oxophthalazin-2-yl]pentanoic acid Traditional Name: 2-[4-[(1,4-dimethylindol-3-yl)methyl]-1-keto-phthalazin-2-yl]valeric acid Formula: C24H25N3O3 MolecularWeight: 403.4736

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)N1C(=O)C2=CC=CC=C2C(=N1)CC3=CN(C4=CC=CC(=C43)C)C

Isomeric SMILES

CCCC(C(=O)O)N1C(=O)C2=CC=CC=C2C(=N1)CC3=CN(C4=CC=CC(=C43)C)C

InChI

InChI=1S/C24H25N3O3/c1-4-8-21(24(29)30)27-23(28)18-11-6-5-10-17(18)19(25-27)13-16-14-26(3)20-12-7-9-15(2)22(16)20/h5-7,9-12,14,21H,4,8,13H2,1-3H3,(H,29,30)