4-[[[(2S)-1-ethylpyrrolidin-2-yl]methylamino]methylidene]-2-phenyl-isoquinoline-1,3-dione

Systemtic Name: 4-[[[(2S)-1-ethylpyrrolidin-2-yl]methylamino]methylidene]-2-phenyl-isoquinoline-1,3-dione Openeye Name: 4-[[[(2S)-1-ethylpyrrolidin-2-yl]methylamino]methylene]-2-phenyl-isoquinoline-1,3-dione CAS Name: 4-[[[(2S)-1-ethyl-2-pyrrolidinyl]methylamino]methylidene]-2-phenylisoquinoline-1,3-dione IUPAC Name: 4-[[[(2S)-1-ethylpyrrolidin-2-yl]methylamino]methylidene]-2-phenylisoquinoline-1,3-dione Traditional Name: 4-[[[(2S)-1-ethylpyrrolidin-2-yl]methylamino]methylene]-2-phenyl-isoquinoline-1,3-quinone Formula: C23H25N3O2 MolecularWeight: 375.4635

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=C4

Isomeric SMILES

CCN1CCC[C@H]1CNC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3O2/c1-2-25-14-8-11-18(25)15-24-16-21-19-12-6-7-13-20(19)22(27)26(23(21)28)17-9-4-3-5-10-17/h3-7,9-10,12-13,16,18,24H,2,8,11,14-15H2,1H3/t18-/m0/s1