(4R)-2-(4-ethoxyphenyl)-4-[[(1R)-1-pyridin-2-ylethyl]iminomethyl]-4H-isoquinoline-1,3-dione

Systemtic Name: (4R)-2-(4-ethoxyphenyl)-4-[[(1R)-1-pyridin-2-ylethyl]iminomethyl]-4H-isoquinoline-1,3-dione Openeye Name: (4R)-2-(4-ethoxyphenyl)-4-[[(1R)-1-(2-pyridyl)ethyl]iminomethyl]-4H-isoquinoline-1,3-dione CAS Name: (4R)-2-(4-ethoxyphenyl)-4-[[(1R)-1-(2-pyridinyl)ethyl]iminomethyl]-4H-isoquinoline-1,3-dione IUPAC Name: (4R)-2-(4-ethoxyphenyl)-4-[[(1R)-1-pyridin-2-ylethyl]iminomethyl]-4H-isoquinoline-1,3-dione Traditional Name: (4R)-2-p-phenetyl-4-[[(1R)-1-(2-pyridyl)ethyl]iminomethyl]-4H-isoquinoline-1,3-quinone Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(C3=CC=CC=C3C2=O)C=NC(C)C4=CC=CC=N4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)[C@H](C3=CC=CC=C3C2=O)C=N[C@H](C)C4=CC=CC=N4

InChI

InChI=1S/C25H23N3O3/c1-3-31-19-13-11-18(12-14-19)28-24(29)21-9-5-4-8-20(21)22(25(28)30)16-27-17(2)23-10-6-7-15-26-23/h4-17,22H,3H2,1-2H3/t17-,22+/m1/s1