(4R)-4-(cyclopentyliminomethyl)-2-(3,4-dimethoxyphenyl)-4H-isoquinoline-1,3-dione

Systemtic Name: (4R)-4-(cyclopentyliminomethyl)-2-(3,4-dimethoxyphenyl)-4H-isoquinoline-1,3-dione Openeye Name: (4R)-4-(cyclopentyliminomethyl)-2-(3,4-dimethoxyphenyl)-4H-isoquinoline-1,3-dione CAS Name: (4R)-4-(cyclopentyliminomethyl)-2-(3,4-dimethoxyphenyl)-4H-isoquinoline-1,3-dione IUPAC Name: (4R)-4-(cyclopentyliminomethyl)-2-(3,4-dimethoxyphenyl)-4H-isoquinoline-1,3-dione Traditional Name: (4R)-4-(cyclopentyliminomethyl)-2-(3,4-dimethoxyphenyl)-4H-isoquinoline-1,3-quinone Formula: C23H24N2O4 MolecularWeight: 392.44766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C(C3=CC=CC=C3C2=O)C=NC4CCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)[C@H](C3=CC=CC=C3C2=O)C=NC4CCCC4)OC

InChI

InChI=1S/C23H24N2O4/c1-28-20-12-11-16(13-21(20)29-2)25-22(26)18-10-6-5-9-17(18)19(23(25)27)14-24-15-7-3-4-8-15/h5-6,9-15,19H,3-4,7-8H2,1-2H3/t19-/m0/s1