4-chloranyl-6-[(2,3-dimethylphenyl)methylamino]-2H-phthalazin-1-one

Systemtic Name: 4-chloranyl-6-[(2,3-dimethylphenyl)methylamino]-2H-phthalazin-1-one Openeye Name: 4-chloro-6-[(2,3-dimethylphenyl)methylamino]-2H-phthalazin-1-one CAS Name: 4-chloro-6-[(2,3-dimethylphenyl)methylamino]-2H-phthalazin-1-one IUPAC Name: 4-chloro-6-[(2,3-dimethylphenyl)methylamino]-2H-phthalazin-1-one Traditional Name: 4-chloro-6-[(2,3-dimethylbenzyl)amino]-2H-phthalazin-1-one Formula: C17H16ClN3O MolecularWeight: 313.78144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)CNC2=CC3=C(C=C2)C(=O)NN=C3Cl)C

Isomeric SMILES

CC1=C(C(=CC=C1)CNC2=CC3=C(C=C2)C(=O)NN=C3Cl)C

InChI

InChI=1S/C17H16ClN3O/c1-10-4-3-5-12(11(10)2)9-19-13-6-7-14-15(8-13)16(18)20-21-17(14)22/h3-8,19H,9H2,1-2H3,(H,21,22)