(4R)-4-(3-imidazol-1-ylpropyliminomethyl)-2-phenyl-4H-isoquinoline-1,3-dione

Systemtic Name: (4R)-4-(3-imidazol-1-ylpropyliminomethyl)-2-phenyl-4H-isoquinoline-1,3-dione Openeye Name: (4R)-4-(3-imidazol-1-ylpropyliminomethyl)-2-phenyl-4H-isoquinoline-1,3-dione CAS Name: (4R)-4-[3-(1-imidazolyl)propyliminomethyl]-2-phenyl-4H-isoquinoline-1,3-dione IUPAC Name: (4R)-4-(3-imidazol-1-ylpropyliminomethyl)-2-phenyl-4H-isoquinoline-1,3-dione Traditional Name: (4R)-4-(3-imidazol-1-ylpropyliminomethyl)-2-phenyl-4H-isoquinoline-1,3-quinone Formula: C22H20N4O2 MolecularWeight: 372.4198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(C3=CC=CC=C3C2=O)C=NCCCN4C=CN=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)[C@H](C3=CC=CC=C3C2=O)C=NCCCN4C=CN=C4

InChI

InChI=1S/C22H20N4O2/c27-21-19-10-5-4-9-18(19)20(15-23-11-6-13-25-14-12-24-16-25)22(28)26(21)17-7-2-1-3-8-17/h1-5,7-10,12,14-16,20H,6,11,13H2/t20-/m0/s1