4-[3-(diethylamino)propyliminomethyl]-2-(2,5-dimethoxyphenyl)-4H-isoquinoline-1,3-dione

Systemtic Name: 4-[3-(diethylamino)propyliminomethyl]-2-(2,5-dimethoxyphenyl)-4H-isoquinoline-1,3-dione Openeye Name: 4-[3-(diethylamino)propyliminomethyl]-2-(2,5-dimethoxyphenyl)-4H-isoquinoline-1,3-dione CAS Name: 4-[3-(diethylamino)propyliminomethyl]-2-(2,5-dimethoxyphenyl)-4H-isoquinoline-1,3-dione IUPAC Name: 4-[3-(diethylamino)propyliminomethyl]-2-(2,5-dimethoxyphenyl)-4H-isoquinoline-1,3-dione Traditional Name: 4-[3-(diethylamino)propyliminomethyl]-2-(2,5-dimethoxyphenyl)-4H-isoquinoline-1,3-quinone Formula: C25H31N3O4 MolecularWeight: 437.53134

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCN=CC1C2=CC=CC=C2C(=O)N(C1=O)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CCN(CC)CCCN=CC1C2=CC=CC=C2C(=O)N(C1=O)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C25H31N3O4/c1-5-27(6-2)15-9-14-26-17-21-19-10-7-8-11-20(19)24(29)28(25(21)30)22-16-18(31-3)12-13-23(22)32-4/h7-8,10-13,16-17,21H,5-6,9,14-15H2,1-4H3