4-[[(1R)-1-(4-methoxyphenyl)propyl]iminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione

Systemtic Name: 4-[[(1R)-1-(4-methoxyphenyl)propyl]iminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Openeye Name: 4-[[(1R)-1-(4-methoxyphenyl)propyl]iminomethyl]-2-(2-pyridyl)-4H-isoquinoline-1,3-dione CAS Name: 4-[[(1R)-1-(4-methoxyphenyl)propyl]iminomethyl]-2-(2-pyridinyl)-4H-isoquinoline-1,3-dione IUPAC Name: 4-[[(1R)-1-(4-methoxyphenyl)propyl]iminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Traditional Name: 4-[[(1R)-1-(4-methoxyphenyl)propyl]iminomethyl]-2-(2-pyridyl)-4H-isoquinoline-1,3-quinone Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)OC)N=CC2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

Isomeric SMILES

CC[C@H](C1=CC=C(C=C1)OC)N=CC2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

InChI

InChI=1S/C25H23N3O3/c1-3-22(17-11-13-18(31-2)14-12-17)27-16-21-19-8-4-5-9-20(19)24(29)28(25(21)30)23-10-6-7-15-26-23/h4-16,21-22H,3H2,1-2H3/t21?,22-/m1/s1