2-(5-azanyl-2-methyl-phenyl)-5-(3-azanylphenoxy)isoindole-1,3-dione

Systemtic Name: 2-(5-azanyl-2-methyl-phenyl)-5-(3-azanylphenoxy)isoindole-1,3-dione Openeye Name: 2-(5-amino-2-methyl-phenyl)-5-(3-aminophenoxy)isoindoline-1,3-dione CAS Name: 2-(5-amino-2-methylphenyl)-5-(3-aminophenoxy)isoindole-1,3-dione IUPAC Name: 2-(5-amino-2-methylphenyl)-5-(3-aminophenoxy)isoindole-1,3-dione Traditional Name: 2-(5-amino-2-methyl-phenyl)-5-(3-aminophenoxy)isoindoline-1,3-quinone Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC(=C4)N

Isomeric SMILES

CC1=C(C=C(C=C1)N)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC(=C4)N

InChI

InChI=1S/C21H17N3O3/c1-12-5-6-14(23)10-19(12)24-20(25)17-8-7-16(11-18(17)21(24)26)27-15-4-2-3-13(22)9-15/h2-11H,22-23H2,1H3