(4E)-4-[(3-methylbutylamino)methylidene]-2-phenyl-isoquinoline-1,3-dione

Systemtic Name: (4E)-4-[(3-methylbutylamino)methylidene]-2-phenyl-isoquinoline-1,3-dione Openeye Name: (4E)-4-[(isopentylamino)methylene]-2-phenyl-isoquinoline-1,3-dione CAS Name: (4E)-4-[(3-methylbutylamino)methylidene]-2-phenylisoquinoline-1,3-dione IUPAC Name: (4E)-4-[(3-methylbutylamino)methylidene]-2-phenylisoquinoline-1,3-dione Traditional Name: (4E)-4-[(isoamylamino)methylene]-2-phenyl-isoquinoline-1,3-quinone Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC=C1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCN/C=C/1\C2=CC=CC=C2C(=O)N(C1=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O2/c1-15(2)12-13-22-14-19-17-10-6-7-11-18(17)20(24)23(21(19)25)16-8-4-3-5-9-16/h3-11,14-15,22H,12-13H2,1-2H3/b19-14+