3-[(4-azanyl-2,5-dimethyl-phenyl)amino]-4,7-bis(chloranyl)isoindol-1-one

Systemtic Name: 3-[(4-azanyl-2,5-dimethyl-phenyl)amino]-4,7-bis(chloranyl)isoindol-1-one Openeye Name: 3-(4-amino-2,5-dimethyl-anilino)-4,7-dichloro-isoindol-1-one CAS Name: 3-(4-amino-2,5-dimethylanilino)-4,7-dichloro-1-isoindolone IUPAC Name: 3-(4-amino-2,5-dimethylanilino)-4,7-dichloroisoindol-1-one Traditional Name: 3-(4-amino-2,5-dimethyl-anilino)-4,7-dichloro-isoindol-1-one Formula: C16H13Cl2N3O MolecularWeight: 334.19992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC2=NC(=O)C3=C(C=CC(=C32)Cl)Cl)C)N

Isomeric SMILES

CC1=CC(=C(C=C1NC2=NC(=O)C3=C(C=CC(=C32)Cl)Cl)C)N

InChI

InChI=1S/C16H13Cl2N3O/c1-7-6-12(8(2)5-11(7)19)20-15-13-9(17)3-4-10(18)14(13)16(22)21-15/h3-6H,19H2,1-2H3,(H,20,21,22)