2-[2-azanyl-2-(3,4-dimethylphenyl)ethyl]phthalazin-1-one

Systemtic Name: 2-[2-azanyl-2-(3,4-dimethylphenyl)ethyl]phthalazin-1-one Openeye Name: 2-[2-amino-2-(3,4-dimethylphenyl)ethyl]phthalazin-1-one CAS Name: 2-[2-amino-2-(3,4-dimethylphenyl)ethyl]-1-phthalazinone IUPAC Name: 2-[2-amino-2-(3,4-dimethylphenyl)ethyl]phthalazin-1-one Traditional Name: 2-[2-amino-2-(3,4-dimethylphenyl)ethyl]phthalazin-1-one Formula: C18H19N3O MolecularWeight: 293.36296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(CN2C(=O)C3=CC=CC=C3C=N2)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(CN2C(=O)C3=CC=CC=C3C=N2)N)C

InChI

InChI=1S/C18H19N3O/c1-12-7-8-14(9-13(12)2)17(19)11-21-18(22)16-6-4-3-5-15(16)10-20-21/h3-10,17H,11,19H2,1-2H3