2-(4-azanyl-2-methyl-phenyl)-7-chloranyl-4H-isoquinoline-1,3-dione

Systemtic Name: 2-(4-azanyl-2-methyl-phenyl)-7-chloranyl-4H-isoquinoline-1,3-dione Openeye Name: 2-(4-amino-2-methyl-phenyl)-7-chloro-4H-isoquinoline-1,3-dione CAS Name: 2-(4-amino-2-methylphenyl)-7-chloro-4H-isoquinoline-1,3-dione IUPAC Name: 2-(4-amino-2-methylphenyl)-7-chloro-4H-isoquinoline-1,3-dione Traditional Name: 2-(4-amino-2-methyl-phenyl)-7-chloro-4H-isoquinoline-1,3-quinone Formula: C16H13ClN2O2 MolecularWeight: 300.73962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N)N2C(=O)CC3=C(C2=O)C=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)N)N2C(=O)CC3=C(C2=O)C=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN2O2/c1-9-6-12(18)4-5-14(9)19-15(20)7-10-2-3-11(17)8-13(10)16(19)21/h2-6,8H,7,18H2,1H3