2-[[(4-azanyl-2-oxidanyl-phenyl)amino]methyl]-5-chloranyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-[[(4-azanyl-2-oxidanyl-phenyl)amino]methyl]-5-chloranyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-[(4-amino-2-hydroxy-anilino)methyl]-5-chloro-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-[(4-amino-2-hydroxyanilino)methyl]-5-chloro-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[(4-amino-2-hydroxyanilino)methyl]-5-chloro-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-[(4-amino-2-hydroxy-anilino)methyl]-5-chloro-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C15H16ClN3O3 MolecularWeight: 321.75884

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(CC2C1C(=O)N(C2=O)CNC3=C(C=C(C=C3)N)O)Cl

Isomeric SMILES

C1C=C(CC2C1C(=O)N(C2=O)CNC3=C(C=C(C=C3)N)O)Cl

InChI

InChI=1S/C15H16ClN3O3/c16-8-1-3-10-11(5-8)15(22)19(14(10)21)7-18-12-4-2-9(17)6-13(12)20/h1-2,4,6,10-11,18,20H,3,5,7,17H2